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description Publicationkeyboard_double_arrow_right Article , Other literature type 2021Publisher:American Chemical Society (ACS) Xiaobo Li; Jianbin Zhang; Nan Zhou; Hua Xu; Rusen Yang;Monolayer tungsten sulfide (WS 2 ), a desirable transition metal chalcogenide semiconductor material for the next generation of promising electronics and optoelectronics applications, has attracted great attention. However, the lack of understanding of the underlying growth mechanism in the chemical vapor deposition process inhibits the precise dimension control of WS 2 and its practical applications. Herein, we discovered that H 2 played an important role in the growth of WS 2 when tungsten trioxide (WO 3 ) was used as W precursor. It was found that a prereduction of WO 3 prior to the WS 2 growth is necessary, and the time to introduce H 2 into the growth system is crucial. The intermediate product of volatile W 18 O 49 contributed to the formation of single-crystal WS 2 only when the H 2 was introduced after the growth temperature reached 850 °C. The Gibbs free energy of the involved reactions was examined, and an intermediate-driven growth mechanism was proposed. The photodetector fabricated from the monolayer WS 2 exhibited a fast response speed and stable performance. A better understanding of the growth mechanism of WS 2 and the photodetector application demonstrated in this work offer guidelines for the study of other 2D materials.
Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)ACS Applied Electronic MaterialsArticle . 2021 . Peer-reviewedLicense: STM Policy #29Data sources: Crossrefadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acsaelm.1c00891&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eu9 citations 9 popularity Top 10% influence Average impulse Top 10% Powered by BIP!
more_vert Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)ACS Applied Electronic MaterialsArticle . 2021 . Peer-reviewedLicense: STM Policy #29Data sources: Crossrefadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acsaelm.1c00891&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eudescription Publicationkeyboard_double_arrow_right Article , Other literature type 2021Publisher:American Chemical Society (ACS) Xiaobo Li; Jianbin Zhang; Nan Zhou; Hua Xu; Rusen Yang;Monolayer tungsten sulfide (WS 2 ), a desirable transition metal chalcogenide semiconductor material for the next generation of promising electronics and optoelectronics applications, has attracted great attention. However, the lack of understanding of the underlying growth mechanism in the chemical vapor deposition process inhibits the precise dimension control of WS 2 and its practical applications. Herein, we discovered that H 2 played an important role in the growth of WS 2 when tungsten trioxide (WO 3 ) was used as W precursor. It was found that a prereduction of WO 3 prior to the WS 2 growth is necessary, and the time to introduce H 2 into the growth system is crucial. The intermediate product of volatile W 18 O 49 contributed to the formation of single-crystal WS 2 only when the H 2 was introduced after the growth temperature reached 850 °C. The Gibbs free energy of the involved reactions was examined, and an intermediate-driven growth mechanism was proposed. The photodetector fabricated from the monolayer WS 2 exhibited a fast response speed and stable performance. A better understanding of the growth mechanism of WS 2 and the photodetector application demonstrated in this work offer guidelines for the study of other 2D materials.
Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)ACS Applied Electronic MaterialsArticle . 2021 . Peer-reviewedLicense: STM Policy #29Data sources: Crossrefadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acsaelm.1c00891&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eu9 citations 9 popularity Top 10% influence Average impulse Top 10% Powered by BIP!
more_vert Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)ACS Applied Electronic MaterialsArticle . 2021 . Peer-reviewedLicense: STM Policy #29Data sources: Crossrefadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acsaelm.1c00891&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eudescription Publicationkeyboard_double_arrow_right Other literature type , Article 2021Publisher:figshare Authors: Iizumi, Toshichika; Hosokawa, Nanae; Wagai, Rota;Additional file 1: Table S1. Base temperature, upper temperature limit and crop water needs used to calculate the season temperature and water balance index. Fig. S1 Comparisons between the observed and modeled yields. Fig. S2 Same as Fig. 4 but for the M3-GSOC dataset combination. Fig. S3 Same as Fig. 4 but for the SPAM-HWSD dataset combination. Fig. S4 Same as Fig. 4 but for the SPAM-GSOC dataset combination. Fig. S5 The potentials of additional SOC stock and yield improvement (the M3-HWSD dataset combination). Fig. S6 Same as Fig. S5 but for the M3-GSOC dataset combination. Fig. S7 Same as Fig. S5 but for the SPAM-HWSD dataset combination. Fig. S8 Same as Fig. S5 but for the SPAM-GSOC dataset combination. Fig. S9 Current N application rate and estimated inorganic N input savings. Fig. S10 Estimated regional crop production increase and inorganic N input savings in relation to estimated additional SOC build-up.
add ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.6084/m9.figshare.16935788.v1&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.euAccess RoutesGreen 0 citations 0 popularity Average influence Average impulse Average Powered by BIP!
more_vert add ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.6084/m9.figshare.16935788.v1&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eudescription Publicationkeyboard_double_arrow_right Other literature type , Article 2021Publisher:figshare Authors: Iizumi, Toshichika; Hosokawa, Nanae; Wagai, Rota;Additional file 1: Table S1. Base temperature, upper temperature limit and crop water needs used to calculate the season temperature and water balance index. Fig. S1 Comparisons between the observed and modeled yields. Fig. S2 Same as Fig. 4 but for the M3-GSOC dataset combination. Fig. S3 Same as Fig. 4 but for the SPAM-HWSD dataset combination. Fig. S4 Same as Fig. 4 but for the SPAM-GSOC dataset combination. Fig. S5 The potentials of additional SOC stock and yield improvement (the M3-HWSD dataset combination). Fig. S6 Same as Fig. S5 but for the M3-GSOC dataset combination. Fig. S7 Same as Fig. S5 but for the SPAM-HWSD dataset combination. Fig. S8 Same as Fig. S5 but for the SPAM-GSOC dataset combination. Fig. S9 Current N application rate and estimated inorganic N input savings. Fig. S10 Estimated regional crop production increase and inorganic N input savings in relation to estimated additional SOC build-up.
add ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.6084/m9.figshare.16935788.v1&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.euAccess RoutesGreen 0 citations 0 popularity Average influence Average impulse Average Powered by BIP!
more_vert add ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.6084/m9.figshare.16935788.v1&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eudescription Publicationkeyboard_double_arrow_right Article , Journal 2021Publisher:American Chemical Society (ACS) Xuewen Wang; Weiming Zhao; Wei Zhang; Ka Wai Wong; Jiawei Wu; Tong Chen; Shaoming Huang;The inferior cycle lifespan and unsatisfactory energy density of traditional anode materials for sodium-ion batteries need to be improved toward actual application. Here, MOF-derived ultrafine ZnSe...
Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)ACS Sustainable Chemistry & EngineeringArticle . 2021 . Peer-reviewedLicense: STM Policy #29Data sources: Crossrefadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acssuschemeng.1c02447&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eu41 citations 41 popularity Top 10% influence Top 10% impulse Top 1% Powered by BIP!
more_vert Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)ACS Sustainable Chemistry & EngineeringArticle . 2021 . Peer-reviewedLicense: STM Policy #29Data sources: Crossrefadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acssuschemeng.1c02447&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eudescription Publicationkeyboard_double_arrow_right Article , Journal 2021Publisher:American Chemical Society (ACS) Xuewen Wang; Weiming Zhao; Wei Zhang; Ka Wai Wong; Jiawei Wu; Tong Chen; Shaoming Huang;The inferior cycle lifespan and unsatisfactory energy density of traditional anode materials for sodium-ion batteries need to be improved toward actual application. Here, MOF-derived ultrafine ZnSe...
Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)ACS Sustainable Chemistry & EngineeringArticle . 2021 . Peer-reviewedLicense: STM Policy #29Data sources: Crossrefadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acssuschemeng.1c02447&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eu41 citations 41 popularity Top 10% influence Top 10% impulse Top 1% Powered by BIP!
more_vert Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)ACS Sustainable Chemistry & EngineeringArticle . 2021 . Peer-reviewedLicense: STM Policy #29Data sources: Crossrefadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acssuschemeng.1c02447&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eudescription Publicationkeyboard_double_arrow_right Article , Journal 2021Publisher:American Chemical Society (ACS) Kang Wu; Jianyue Jiao; Na Li; Min Wang; Guofeng Jia; Yu Lin Lee; Rongbin Dang; Xin Deng; Xiaoling Xiao; Zhijian Wu;Layered O3-phase LiNi0.8Co0.1Mn0.1O2 (NCM811) material has shown great potential for lithium-ion batteries (LIBs). However, capacity attenuation and irreversible phase transitions have been serious...
Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)The Journal of Physical Chemistry CArticle . 2021 . Peer-reviewedLicense: STM Policy #29Data sources: Crossrefadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acs.jpcc.1c01727&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eu21 citations 21 popularity Top 10% influence Average impulse Top 10% Powered by BIP!
more_vert Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)The Journal of Physical Chemistry CArticle . 2021 . Peer-reviewedLicense: STM Policy #29Data sources: Crossrefadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acs.jpcc.1c01727&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eudescription Publicationkeyboard_double_arrow_right Article , Journal 2021Publisher:American Chemical Society (ACS) Kang Wu; Jianyue Jiao; Na Li; Min Wang; Guofeng Jia; Yu Lin Lee; Rongbin Dang; Xin Deng; Xiaoling Xiao; Zhijian Wu;Layered O3-phase LiNi0.8Co0.1Mn0.1O2 (NCM811) material has shown great potential for lithium-ion batteries (LIBs). However, capacity attenuation and irreversible phase transitions have been serious...
Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)The Journal of Physical Chemistry CArticle . 2021 . Peer-reviewedLicense: STM Policy #29Data sources: Crossrefadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acs.jpcc.1c01727&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eu21 citations 21 popularity Top 10% influence Average impulse Top 10% Powered by BIP!
more_vert Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)The Journal of Physical Chemistry CArticle . 2021 . Peer-reviewedLicense: STM Policy #29Data sources: Crossrefadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acs.jpcc.1c01727&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eudescription Publicationkeyboard_double_arrow_right Article , Journal 2021Publisher:American Chemical Society (ACS) Jingyi Yang; Xiaoyuan Lin; Na Xing; Zhao Zhang; Haiwei Zhang; Haibo Wu; Weiwei Xue;pmid: 34279924
The continual spread of novel coronavirus disease 2019 (COVID-19) is caused by severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2), posing a severe threat to the health worldwide. The main protease (Mpro, alias 3CLpro) of SARS-CoV-2 is a crucial enzyme for the maturation of viral particles and is a very attractive target for designing drugs to treat COVID-19. Here, we propose a multiple conformation-based virtual screening strategy to discover inhibitors that can target SARS-CoV-2 Mpro. Based on this strategy, nine Mpro structures and a protein mimetics library with 8960 commercially available compounds were prepared to carry out ensemble docking for the first time. Five of the nine structures are apo forms presented in different conformations, whereas the other four structures are holo forms complexed with different ligands. The surface plasmon resonance assay revealed that 6 out of 49 compounds had the ability to bind to SARS-CoV-2 Mpro. The fluorescence resonance energy transfer experiment showed that the biochemical half-maximal inhibitory concentration (IC50) values of the six compounds could hamper Mpro activities ranged from 0.69 ± 0.05 to 2.05 ± 0.92 μM. Evaluation of antiviral activity using the cell-based assay indicated that two compounds (Z1244904919 and Z1759961356) could strongly inhibit the cytopathic effect and reduce replication of the living virus in Vero E6 cells with the half-maximal effective concentrations (EC50) of 4.98 ± 1.83 and 8.52 ± 0.92 μM, respectively. The mechanism of the action for the two inhibitors were further elucidated at the molecular level by molecular dynamics simulation and subsequent binding free energy analysis. As a result, the discovered noncovalent reversible inhibitors with novel scaffolds are promising antiviral drug candidates, which may be used to develop the treatment of COVID-19.
Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 1753License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)Smithsonian figshareArticle . 1753License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)Journal of Chemical Information and ModelingArticle . 2021 . Peer-reviewedLicense: https://doi.org/10.15223/policy-001Data sources: Crossrefadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acs.jcim.1c00355&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.euAccess Routesbronze 61 citations 61 popularity Top 1% influence Top 10% impulse Top 1% Powered by BIP!
more_vert Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 1753License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)Smithsonian figshareArticle . 1753License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)Journal of Chemical Information and ModelingArticle . 2021 . Peer-reviewedLicense: https://doi.org/10.15223/policy-001Data sources: Crossrefadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acs.jcim.1c00355&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eudescription Publicationkeyboard_double_arrow_right Article , Journal 2021Publisher:American Chemical Society (ACS) Jingyi Yang; Xiaoyuan Lin; Na Xing; Zhao Zhang; Haiwei Zhang; Haibo Wu; Weiwei Xue;pmid: 34279924
The continual spread of novel coronavirus disease 2019 (COVID-19) is caused by severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2), posing a severe threat to the health worldwide. The main protease (Mpro, alias 3CLpro) of SARS-CoV-2 is a crucial enzyme for the maturation of viral particles and is a very attractive target for designing drugs to treat COVID-19. Here, we propose a multiple conformation-based virtual screening strategy to discover inhibitors that can target SARS-CoV-2 Mpro. Based on this strategy, nine Mpro structures and a protein mimetics library with 8960 commercially available compounds were prepared to carry out ensemble docking for the first time. Five of the nine structures are apo forms presented in different conformations, whereas the other four structures are holo forms complexed with different ligands. The surface plasmon resonance assay revealed that 6 out of 49 compounds had the ability to bind to SARS-CoV-2 Mpro. The fluorescence resonance energy transfer experiment showed that the biochemical half-maximal inhibitory concentration (IC50) values of the six compounds could hamper Mpro activities ranged from 0.69 ± 0.05 to 2.05 ± 0.92 μM. Evaluation of antiviral activity using the cell-based assay indicated that two compounds (Z1244904919 and Z1759961356) could strongly inhibit the cytopathic effect and reduce replication of the living virus in Vero E6 cells with the half-maximal effective concentrations (EC50) of 4.98 ± 1.83 and 8.52 ± 0.92 μM, respectively. The mechanism of the action for the two inhibitors were further elucidated at the molecular level by molecular dynamics simulation and subsequent binding free energy analysis. As a result, the discovered noncovalent reversible inhibitors with novel scaffolds are promising antiviral drug candidates, which may be used to develop the treatment of COVID-19.
Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 1753License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)Smithsonian figshareArticle . 1753License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)Journal of Chemical Information and ModelingArticle . 2021 . Peer-reviewedLicense: https://doi.org/10.15223/policy-001Data sources: Crossrefadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acs.jcim.1c00355&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.euAccess Routesbronze 61 citations 61 popularity Top 1% influence Top 10% impulse Top 1% Powered by BIP!
more_vert Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 1753License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)Smithsonian figshareArticle . 1753License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)Journal of Chemical Information and ModelingArticle . 2021 . Peer-reviewedLicense: https://doi.org/10.15223/policy-001Data sources: Crossrefadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acs.jcim.1c00355&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eudescription Publicationkeyboard_double_arrow_right Article , Other literature type 2021Publisher:American Chemical Society (ACS) Authors: Itisha Dwivedi; Chandramouli Subramaniam;Soft graphitizable carbon-based multifunctional nanomaterials have found versatile applications ranging from energy storage to quantum computing. In contrast, their hard-carbon analogues have been poorly investigated from both fundamental and application-oriented perspectives. The predominant challenges have been (a) the lack of approaches to fabricate porous hard-carbons and (b) their thermally nongraphitizable nature, leading to inaccessibility for several potential applications. In this direction, we present design principles for fabrication of porous hard-carbon-based nanostructured carbon florets (NCFs) with a highly accessible surface area (∼936 m2/g), rivalling their soft-carbon counterparts. Subjecting such thermally stable hard-carbons to a synergistic combination of an electric field and Joule heating drives their transformation to free-standing macroscopic monoliths composed of onion-like carbons (OLCMs). This represents the first such structural transformation observed in sp2-based hard-carbon NCFs to sp2-networked OLCMs. Micro-Raman spectroscopy establishes the simultaneous increase in the intensity of D-, 2D-, and D + G-bands at 1341, 2712, and 2936 cm-1 and is correlated to the reorganization in the disordered graphitic domains of NCFs to curved concentric nested spheres in OLCMs. This therefore completely precludes the formation of a nanodiamond core that has been consistently observed in all previously reported OLCs. The Joule heating-driven formation of OLCMs is accompanied by ∼5700% enhancement in electrical conductivity that is brought about by the fusion of outermost graphitic shells of OLCs to result in monolithic OLC structures (OLCMs). The porous and inter-networked OLCMs exhibit an excellent adsorption-based capture of volatile organic compounds such as toluene at high efficiencies (∼99%) over a concentration range (0.22-1.86 ppm) that is relevant for direct applications such as smoke filters in cigarettes.
Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)add ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acsmaterialsau.1c00062&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.euAccess RoutesGreen gold 13 citations 13 popularity Top 10% influence Average impulse Top 10% Powered by BIP!
more_vert Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)add ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acsmaterialsau.1c00062&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eudescription Publicationkeyboard_double_arrow_right Article , Other literature type 2021Publisher:American Chemical Society (ACS) Authors: Itisha Dwivedi; Chandramouli Subramaniam;Soft graphitizable carbon-based multifunctional nanomaterials have found versatile applications ranging from energy storage to quantum computing. In contrast, their hard-carbon analogues have been poorly investigated from both fundamental and application-oriented perspectives. The predominant challenges have been (a) the lack of approaches to fabricate porous hard-carbons and (b) their thermally nongraphitizable nature, leading to inaccessibility for several potential applications. In this direction, we present design principles for fabrication of porous hard-carbon-based nanostructured carbon florets (NCFs) with a highly accessible surface area (∼936 m2/g), rivalling their soft-carbon counterparts. Subjecting such thermally stable hard-carbons to a synergistic combination of an electric field and Joule heating drives their transformation to free-standing macroscopic monoliths composed of onion-like carbons (OLCMs). This represents the first such structural transformation observed in sp2-based hard-carbon NCFs to sp2-networked OLCMs. Micro-Raman spectroscopy establishes the simultaneous increase in the intensity of D-, 2D-, and D + G-bands at 1341, 2712, and 2936 cm-1 and is correlated to the reorganization in the disordered graphitic domains of NCFs to curved concentric nested spheres in OLCMs. This therefore completely precludes the formation of a nanodiamond core that has been consistently observed in all previously reported OLCs. The Joule heating-driven formation of OLCMs is accompanied by ∼5700% enhancement in electrical conductivity that is brought about by the fusion of outermost graphitic shells of OLCs to result in monolithic OLC structures (OLCMs). The porous and inter-networked OLCMs exhibit an excellent adsorption-based capture of volatile organic compounds such as toluene at high efficiencies (∼99%) over a concentration range (0.22-1.86 ppm) that is relevant for direct applications such as smoke filters in cigarettes.
Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)add ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acsmaterialsau.1c00062&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.euAccess RoutesGreen gold 13 citations 13 popularity Top 10% influence Average impulse Top 10% Powered by BIP!
more_vert Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)add ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acsmaterialsau.1c00062&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eudescription Publicationkeyboard_double_arrow_right Article 2021Authors: Angus W. Naylor (11502419); James D. Ford (6095315); Tristan Pearce (4620556); David Fawcett (11502422); +2 AuthorsAngus W. Naylor (11502419); James D. Ford (6095315); Tristan Pearce (4620556); David Fawcett (11502422); Dylan Clark (11502425); James van Alstine (11502428);(DOCX)
Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BYData sources: Bielefeld Academic Search Engine (BASE)add ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=base_search_::d4acba308aad0f9f8e0066c91e0ba1ef&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eu0 citations 0 popularity Average influence Average impulse Average Powered by BIP!
more_vert Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BYData sources: Bielefeld Academic Search Engine (BASE)add ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=base_search_::d4acba308aad0f9f8e0066c91e0ba1ef&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eudescription Publicationkeyboard_double_arrow_right Article 2021Authors: Angus W. Naylor (11502419); James D. Ford (6095315); Tristan Pearce (4620556); David Fawcett (11502422); +2 AuthorsAngus W. Naylor (11502419); James D. Ford (6095315); Tristan Pearce (4620556); David Fawcett (11502422); Dylan Clark (11502425); James van Alstine (11502428);(DOCX)
Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BYData sources: Bielefeld Academic Search Engine (BASE)add ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=base_search_::d4acba308aad0f9f8e0066c91e0ba1ef&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eu0 citations 0 popularity Average influence Average impulse Average Powered by BIP!
more_vert Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BYData sources: Bielefeld Academic Search Engine (BASE)add ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=base_search_::d4acba308aad0f9f8e0066c91e0ba1ef&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eudescription Publicationkeyboard_double_arrow_right Article , Journal 2021Embargo end date: 26 Jul 2021 Spain, Switzerland, SpainPublisher:American Chemical Society (ACS) Sebastiano Carlo D’Angelo; Selene Cobo; Victor Tulus; Abhinandan Nabera; Antonio José Martín; Javier Pérez-Ramírez; Gonzalo Guillén-Gosálbez;handle: 10902/33795
At present, the synthesis of ammonia through the Haber-Bosch (HB) process accounts for 1.2% of the global carbon emissions, representing roughly one-fourth of the global fossil consumption from the chemical industry, which creates a pressing need for alternative low-carbon synthesis routes. Analyzing seven essential planetary boundaries (PBs) for the safe operation of our planet, we find that the standard HB process is unsustainable as it vastly transgresses the climate change PB. In order to identify more responsible strategies from this integrated perspective, we assess the absolute sustainability level of 34 alternative routes where hydrogen (H-2) is supplied by steam methane reforming with carbon capture and storage, biomass gasification, or water electrolysis powered by various energy sources. We found that some of these scenarios could substantially reduce the global impact of fossil HB, yet alleviating the impact on climate change could critically exacerbate the impacts on other Earth-system processes. Furthermore, we identify that reducing the cost of electrolytic H-2 is the main avenue toward the economic appeal of the most sustainable routes. Our work highlights the need to embrace global impacts beyond climate change in the assessment of decarbonization routes of fossil chemicals. This approach enabled us to identify more suitable alternatives and associated challenges toward environmental and economically attractive ammonia synthesis. ACS Sustainable Chemistry & Engineering, 9 (29) ISSN:2168-0485
Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)ACS Sustainable Chemistry & EngineeringArticle . 2021 . Peer-reviewedLicense: CC BYData sources: CrossrefRecolector de Ciencia Abierta, RECOLECTAArticle . 2024License: CC BYData sources: Recolector de Ciencia Abierta, RECOLECTAadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acssuschemeng.1c01915&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.euAccess RoutesGreen hybrid 61 citations 61 popularity Top 10% influence Top 10% impulse Top 1% Powered by BIP!
visibility 196visibility views 196 download downloads 25 Powered bymore_vert Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)ACS Sustainable Chemistry & EngineeringArticle . 2021 . Peer-reviewedLicense: CC BYData sources: CrossrefRecolector de Ciencia Abierta, RECOLECTAArticle . 2024License: CC BYData sources: Recolector de Ciencia Abierta, RECOLECTAadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acssuschemeng.1c01915&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eudescription Publicationkeyboard_double_arrow_right Article , Journal 2021Embargo end date: 26 Jul 2021 Spain, Switzerland, SpainPublisher:American Chemical Society (ACS) Sebastiano Carlo D’Angelo; Selene Cobo; Victor Tulus; Abhinandan Nabera; Antonio José Martín; Javier Pérez-Ramírez; Gonzalo Guillén-Gosálbez;handle: 10902/33795
At present, the synthesis of ammonia through the Haber-Bosch (HB) process accounts for 1.2% of the global carbon emissions, representing roughly one-fourth of the global fossil consumption from the chemical industry, which creates a pressing need for alternative low-carbon synthesis routes. Analyzing seven essential planetary boundaries (PBs) for the safe operation of our planet, we find that the standard HB process is unsustainable as it vastly transgresses the climate change PB. In order to identify more responsible strategies from this integrated perspective, we assess the absolute sustainability level of 34 alternative routes where hydrogen (H-2) is supplied by steam methane reforming with carbon capture and storage, biomass gasification, or water electrolysis powered by various energy sources. We found that some of these scenarios could substantially reduce the global impact of fossil HB, yet alleviating the impact on climate change could critically exacerbate the impacts on other Earth-system processes. Furthermore, we identify that reducing the cost of electrolytic H-2 is the main avenue toward the economic appeal of the most sustainable routes. Our work highlights the need to embrace global impacts beyond climate change in the assessment of decarbonization routes of fossil chemicals. This approach enabled us to identify more suitable alternatives and associated challenges toward environmental and economically attractive ammonia synthesis. ACS Sustainable Chemistry & Engineering, 9 (29) ISSN:2168-0485
Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)ACS Sustainable Chemistry & EngineeringArticle . 2021 . Peer-reviewedLicense: CC BYData sources: CrossrefRecolector de Ciencia Abierta, RECOLECTAArticle . 2024License: CC BYData sources: Recolector de Ciencia Abierta, RECOLECTAadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acssuschemeng.1c01915&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.euAccess RoutesGreen hybrid 61 citations 61 popularity Top 10% influence Top 10% impulse Top 1% Powered by BIP!
visibility 196visibility views 196 download downloads 25 Powered bymore_vert Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)ACS Sustainable Chemistry & EngineeringArticle . 2021 . Peer-reviewedLicense: CC BYData sources: CrossrefRecolector de Ciencia Abierta, RECOLECTAArticle . 2024License: CC BYData sources: Recolector de Ciencia Abierta, RECOLECTAadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acssuschemeng.1c01915&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eudescription Publicationkeyboard_double_arrow_right Article , Other literature type , Journal 2021Publisher:Informa UK Limited Funded by:EC | STRENTEXEC| STRENTEXAuthors: Ali, Adnan E.; Jeoti, Varun; Stojanović, Goran M.;Wearable power supply devices and systems are important necessities for the emerging textile electronic applications. Current energy supply devices usually need more space than the device they power, and are often based on rigid and bulky materials, making them difficult to wear. Fabric-based batteries without any rigid electrical components are therefore ideal candidates to solve the problem of powering these devices. Printing technologies have greater potential in manufacturing lightweight and low-cost batteries with high areal capacity and generating high voltages which are crucial for electronic textile (e-textile) applications. In this review, we present various printing techniques, and battery chemistries applied for smart fabrics, and give a comparison between them in terms of their potential to power the next generation of electronic textiles. Series combinations of many of these printed and distributed battery cells, using electrically conducting threads, have demonstrated their ability to power different electronic devices with a specific voltage and current requirements. Therefore, the present review summarizes the chemistries and material components of several flexible and textile-based batteries, and provides an outlook for the future development of fabric-based printed batteries for wearable and electronic textile applications with enhanced level of DC voltage and current for long periods of time.
Science and Technolo... arrow_drop_down Science and Technology of Advanced MaterialsArticle . Peer-reviewedLicense: CC BYData sources: SygmaSmithsonian figshareArticle . 2021License: CC BYData sources: Bielefeld Academic Search Engine (BASE)Science and Technology of Advanced MaterialsArticle . 2021 . Peer-reviewedLicense: CC BYData sources: CrossrefScience and Technology of Advanced MaterialsArticle . 2021 . Peer-reviewedData sources: European Union Open Data Portaladd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1080/14686996.2021.1962203&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.euAccess RoutesGreen gold 23 citations 23 popularity Top 10% influence Average impulse Top 10% Powered by BIP!
more_vert Science and Technolo... arrow_drop_down Science and Technology of Advanced MaterialsArticle . Peer-reviewedLicense: CC BYData sources: SygmaSmithsonian figshareArticle . 2021License: CC BYData sources: Bielefeld Academic Search Engine (BASE)Science and Technology of Advanced MaterialsArticle . 2021 . Peer-reviewedLicense: CC BYData sources: CrossrefScience and Technology of Advanced MaterialsArticle . 2021 . Peer-reviewedData sources: European Union Open Data Portaladd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1080/14686996.2021.1962203&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eudescription Publicationkeyboard_double_arrow_right Article , Other literature type , Journal 2021Publisher:Informa UK Limited Funded by:EC | STRENTEXEC| STRENTEXAuthors: Ali, Adnan E.; Jeoti, Varun; Stojanović, Goran M.;Wearable power supply devices and systems are important necessities for the emerging textile electronic applications. Current energy supply devices usually need more space than the device they power, and are often based on rigid and bulky materials, making them difficult to wear. Fabric-based batteries without any rigid electrical components are therefore ideal candidates to solve the problem of powering these devices. Printing technologies have greater potential in manufacturing lightweight and low-cost batteries with high areal capacity and generating high voltages which are crucial for electronic textile (e-textile) applications. In this review, we present various printing techniques, and battery chemistries applied for smart fabrics, and give a comparison between them in terms of their potential to power the next generation of electronic textiles. Series combinations of many of these printed and distributed battery cells, using electrically conducting threads, have demonstrated their ability to power different electronic devices with a specific voltage and current requirements. Therefore, the present review summarizes the chemistries and material components of several flexible and textile-based batteries, and provides an outlook for the future development of fabric-based printed batteries for wearable and electronic textile applications with enhanced level of DC voltage and current for long periods of time.
Science and Technolo... arrow_drop_down Science and Technology of Advanced MaterialsArticle . Peer-reviewedLicense: CC BYData sources: SygmaSmithsonian figshareArticle . 2021License: CC BYData sources: Bielefeld Academic Search Engine (BASE)Science and Technology of Advanced MaterialsArticle . 2021 . Peer-reviewedLicense: CC BYData sources: CrossrefScience and Technology of Advanced MaterialsArticle . 2021 . Peer-reviewedData sources: European Union Open Data Portaladd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1080/14686996.2021.1962203&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.euAccess RoutesGreen gold 23 citations 23 popularity Top 10% influence Average impulse Top 10% Powered by BIP!
more_vert Science and Technolo... arrow_drop_down Science and Technology of Advanced MaterialsArticle . Peer-reviewedLicense: CC BYData sources: SygmaSmithsonian figshareArticle . 2021License: CC BYData sources: Bielefeld Academic Search Engine (BASE)Science and Technology of Advanced MaterialsArticle . 2021 . Peer-reviewedLicense: CC BYData sources: CrossrefScience and Technology of Advanced MaterialsArticle . 2021 . Peer-reviewedData sources: European Union Open Data Portaladd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1080/14686996.2021.1962203&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eudescription Publicationkeyboard_double_arrow_right Other literature type , Article 2021Publisher:figshare Authors: Laur, Celia; Corrado, Ann Marie; Grimshaw, Jeremy M.; Ivers, Noah;Additional file 1. Interview Guide.
add ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.6084/m9.figshare.14361317.v1&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.euAccess RoutesGreen 0 citations 0 popularity Average influence Average impulse Average Powered by BIP!
more_vert add ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.6084/m9.figshare.14361317.v1&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eudescription Publicationkeyboard_double_arrow_right Other literature type , Article 2021Publisher:figshare Authors: Laur, Celia; Corrado, Ann Marie; Grimshaw, Jeremy M.; Ivers, Noah;Additional file 1. Interview Guide.
add ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.6084/m9.figshare.14361317.v1&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.euAccess RoutesGreen 0 citations 0 popularity Average influence Average impulse Average Powered by BIP!
more_vert add ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
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description Publicationkeyboard_double_arrow_right Article , Other literature type 2021Publisher:American Chemical Society (ACS) Xiaobo Li; Jianbin Zhang; Nan Zhou; Hua Xu; Rusen Yang;Monolayer tungsten sulfide (WS 2 ), a desirable transition metal chalcogenide semiconductor material for the next generation of promising electronics and optoelectronics applications, has attracted great attention. However, the lack of understanding of the underlying growth mechanism in the chemical vapor deposition process inhibits the precise dimension control of WS 2 and its practical applications. Herein, we discovered that H 2 played an important role in the growth of WS 2 when tungsten trioxide (WO 3 ) was used as W precursor. It was found that a prereduction of WO 3 prior to the WS 2 growth is necessary, and the time to introduce H 2 into the growth system is crucial. The intermediate product of volatile W 18 O 49 contributed to the formation of single-crystal WS 2 only when the H 2 was introduced after the growth temperature reached 850 °C. The Gibbs free energy of the involved reactions was examined, and an intermediate-driven growth mechanism was proposed. The photodetector fabricated from the monolayer WS 2 exhibited a fast response speed and stable performance. A better understanding of the growth mechanism of WS 2 and the photodetector application demonstrated in this work offer guidelines for the study of other 2D materials.
Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)ACS Applied Electronic MaterialsArticle . 2021 . Peer-reviewedLicense: STM Policy #29Data sources: Crossrefadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acsaelm.1c00891&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eu9 citations 9 popularity Top 10% influence Average impulse Top 10% Powered by BIP!
more_vert Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)ACS Applied Electronic MaterialsArticle . 2021 . Peer-reviewedLicense: STM Policy #29Data sources: Crossrefadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acsaelm.1c00891&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eudescription Publicationkeyboard_double_arrow_right Article , Other literature type 2021Publisher:American Chemical Society (ACS) Xiaobo Li; Jianbin Zhang; Nan Zhou; Hua Xu; Rusen Yang;Monolayer tungsten sulfide (WS 2 ), a desirable transition metal chalcogenide semiconductor material for the next generation of promising electronics and optoelectronics applications, has attracted great attention. However, the lack of understanding of the underlying growth mechanism in the chemical vapor deposition process inhibits the precise dimension control of WS 2 and its practical applications. Herein, we discovered that H 2 played an important role in the growth of WS 2 when tungsten trioxide (WO 3 ) was used as W precursor. It was found that a prereduction of WO 3 prior to the WS 2 growth is necessary, and the time to introduce H 2 into the growth system is crucial. The intermediate product of volatile W 18 O 49 contributed to the formation of single-crystal WS 2 only when the H 2 was introduced after the growth temperature reached 850 °C. The Gibbs free energy of the involved reactions was examined, and an intermediate-driven growth mechanism was proposed. The photodetector fabricated from the monolayer WS 2 exhibited a fast response speed and stable performance. A better understanding of the growth mechanism of WS 2 and the photodetector application demonstrated in this work offer guidelines for the study of other 2D materials.
Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)ACS Applied Electronic MaterialsArticle . 2021 . Peer-reviewedLicense: STM Policy #29Data sources: Crossrefadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acsaelm.1c00891&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eu9 citations 9 popularity Top 10% influence Average impulse Top 10% Powered by BIP!
more_vert Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)ACS Applied Electronic MaterialsArticle . 2021 . Peer-reviewedLicense: STM Policy #29Data sources: Crossrefadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acsaelm.1c00891&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eudescription Publicationkeyboard_double_arrow_right Other literature type , Article 2021Publisher:figshare Authors: Iizumi, Toshichika; Hosokawa, Nanae; Wagai, Rota;Additional file 1: Table S1. Base temperature, upper temperature limit and crop water needs used to calculate the season temperature and water balance index. Fig. S1 Comparisons between the observed and modeled yields. Fig. S2 Same as Fig. 4 but for the M3-GSOC dataset combination. Fig. S3 Same as Fig. 4 but for the SPAM-HWSD dataset combination. Fig. S4 Same as Fig. 4 but for the SPAM-GSOC dataset combination. Fig. S5 The potentials of additional SOC stock and yield improvement (the M3-HWSD dataset combination). Fig. S6 Same as Fig. S5 but for the M3-GSOC dataset combination. Fig. S7 Same as Fig. S5 but for the SPAM-HWSD dataset combination. Fig. S8 Same as Fig. S5 but for the SPAM-GSOC dataset combination. Fig. S9 Current N application rate and estimated inorganic N input savings. Fig. S10 Estimated regional crop production increase and inorganic N input savings in relation to estimated additional SOC build-up.
add ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.6084/m9.figshare.16935788.v1&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.euAccess RoutesGreen 0 citations 0 popularity Average influence Average impulse Average Powered by BIP!
more_vert add ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.6084/m9.figshare.16935788.v1&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eudescription Publicationkeyboard_double_arrow_right Other literature type , Article 2021Publisher:figshare Authors: Iizumi, Toshichika; Hosokawa, Nanae; Wagai, Rota;Additional file 1: Table S1. Base temperature, upper temperature limit and crop water needs used to calculate the season temperature and water balance index. Fig. S1 Comparisons between the observed and modeled yields. Fig. S2 Same as Fig. 4 but for the M3-GSOC dataset combination. Fig. S3 Same as Fig. 4 but for the SPAM-HWSD dataset combination. Fig. S4 Same as Fig. 4 but for the SPAM-GSOC dataset combination. Fig. S5 The potentials of additional SOC stock and yield improvement (the M3-HWSD dataset combination). Fig. S6 Same as Fig. S5 but for the M3-GSOC dataset combination. Fig. S7 Same as Fig. S5 but for the SPAM-HWSD dataset combination. Fig. S8 Same as Fig. S5 but for the SPAM-GSOC dataset combination. Fig. S9 Current N application rate and estimated inorganic N input savings. Fig. S10 Estimated regional crop production increase and inorganic N input savings in relation to estimated additional SOC build-up.
add ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.6084/m9.figshare.16935788.v1&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.euAccess RoutesGreen 0 citations 0 popularity Average influence Average impulse Average Powered by BIP!
more_vert add ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.6084/m9.figshare.16935788.v1&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eudescription Publicationkeyboard_double_arrow_right Article , Journal 2021Publisher:American Chemical Society (ACS) Xuewen Wang; Weiming Zhao; Wei Zhang; Ka Wai Wong; Jiawei Wu; Tong Chen; Shaoming Huang;The inferior cycle lifespan and unsatisfactory energy density of traditional anode materials for sodium-ion batteries need to be improved toward actual application. Here, MOF-derived ultrafine ZnSe...
Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)ACS Sustainable Chemistry & EngineeringArticle . 2021 . Peer-reviewedLicense: STM Policy #29Data sources: Crossrefadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acssuschemeng.1c02447&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eu41 citations 41 popularity Top 10% influence Top 10% impulse Top 1% Powered by BIP!
more_vert Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)ACS Sustainable Chemistry & EngineeringArticle . 2021 . Peer-reviewedLicense: STM Policy #29Data sources: Crossrefadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acssuschemeng.1c02447&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eudescription Publicationkeyboard_double_arrow_right Article , Journal 2021Publisher:American Chemical Society (ACS) Xuewen Wang; Weiming Zhao; Wei Zhang; Ka Wai Wong; Jiawei Wu; Tong Chen; Shaoming Huang;The inferior cycle lifespan and unsatisfactory energy density of traditional anode materials for sodium-ion batteries need to be improved toward actual application. Here, MOF-derived ultrafine ZnSe...
Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)ACS Sustainable Chemistry & EngineeringArticle . 2021 . Peer-reviewedLicense: STM Policy #29Data sources: Crossrefadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acssuschemeng.1c02447&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eu41 citations 41 popularity Top 10% influence Top 10% impulse Top 1% Powered by BIP!
more_vert Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)ACS Sustainable Chemistry & EngineeringArticle . 2021 . Peer-reviewedLicense: STM Policy #29Data sources: Crossrefadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acssuschemeng.1c02447&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eudescription Publicationkeyboard_double_arrow_right Article , Journal 2021Publisher:American Chemical Society (ACS) Kang Wu; Jianyue Jiao; Na Li; Min Wang; Guofeng Jia; Yu Lin Lee; Rongbin Dang; Xin Deng; Xiaoling Xiao; Zhijian Wu;Layered O3-phase LiNi0.8Co0.1Mn0.1O2 (NCM811) material has shown great potential for lithium-ion batteries (LIBs). However, capacity attenuation and irreversible phase transitions have been serious...
Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)The Journal of Physical Chemistry CArticle . 2021 . Peer-reviewedLicense: STM Policy #29Data sources: Crossrefadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acs.jpcc.1c01727&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eu21 citations 21 popularity Top 10% influence Average impulse Top 10% Powered by BIP!
more_vert Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)The Journal of Physical Chemistry CArticle . 2021 . Peer-reviewedLicense: STM Policy #29Data sources: Crossrefadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acs.jpcc.1c01727&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eudescription Publicationkeyboard_double_arrow_right Article , Journal 2021Publisher:American Chemical Society (ACS) Kang Wu; Jianyue Jiao; Na Li; Min Wang; Guofeng Jia; Yu Lin Lee; Rongbin Dang; Xin Deng; Xiaoling Xiao; Zhijian Wu;Layered O3-phase LiNi0.8Co0.1Mn0.1O2 (NCM811) material has shown great potential for lithium-ion batteries (LIBs). However, capacity attenuation and irreversible phase transitions have been serious...
Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)The Journal of Physical Chemistry CArticle . 2021 . Peer-reviewedLicense: STM Policy #29Data sources: Crossrefadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acs.jpcc.1c01727&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eu21 citations 21 popularity Top 10% influence Average impulse Top 10% Powered by BIP!
more_vert Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)The Journal of Physical Chemistry CArticle . 2021 . Peer-reviewedLicense: STM Policy #29Data sources: Crossrefadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acs.jpcc.1c01727&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eudescription Publicationkeyboard_double_arrow_right Article , Journal 2021Publisher:American Chemical Society (ACS) Jingyi Yang; Xiaoyuan Lin; Na Xing; Zhao Zhang; Haiwei Zhang; Haibo Wu; Weiwei Xue;pmid: 34279924
The continual spread of novel coronavirus disease 2019 (COVID-19) is caused by severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2), posing a severe threat to the health worldwide. The main protease (Mpro, alias 3CLpro) of SARS-CoV-2 is a crucial enzyme for the maturation of viral particles and is a very attractive target for designing drugs to treat COVID-19. Here, we propose a multiple conformation-based virtual screening strategy to discover inhibitors that can target SARS-CoV-2 Mpro. Based on this strategy, nine Mpro structures and a protein mimetics library with 8960 commercially available compounds were prepared to carry out ensemble docking for the first time. Five of the nine structures are apo forms presented in different conformations, whereas the other four structures are holo forms complexed with different ligands. The surface plasmon resonance assay revealed that 6 out of 49 compounds had the ability to bind to SARS-CoV-2 Mpro. The fluorescence resonance energy transfer experiment showed that the biochemical half-maximal inhibitory concentration (IC50) values of the six compounds could hamper Mpro activities ranged from 0.69 ± 0.05 to 2.05 ± 0.92 μM. Evaluation of antiviral activity using the cell-based assay indicated that two compounds (Z1244904919 and Z1759961356) could strongly inhibit the cytopathic effect and reduce replication of the living virus in Vero E6 cells with the half-maximal effective concentrations (EC50) of 4.98 ± 1.83 and 8.52 ± 0.92 μM, respectively. The mechanism of the action for the two inhibitors were further elucidated at the molecular level by molecular dynamics simulation and subsequent binding free energy analysis. As a result, the discovered noncovalent reversible inhibitors with novel scaffolds are promising antiviral drug candidates, which may be used to develop the treatment of COVID-19.
Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 1753License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)Smithsonian figshareArticle . 1753License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)Journal of Chemical Information and ModelingArticle . 2021 . Peer-reviewedLicense: https://doi.org/10.15223/policy-001Data sources: Crossrefadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acs.jcim.1c00355&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.euAccess Routesbronze 61 citations 61 popularity Top 1% influence Top 10% impulse Top 1% Powered by BIP!
more_vert Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 1753License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)Smithsonian figshareArticle . 1753License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)Journal of Chemical Information and ModelingArticle . 2021 . Peer-reviewedLicense: https://doi.org/10.15223/policy-001Data sources: Crossrefadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acs.jcim.1c00355&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eudescription Publicationkeyboard_double_arrow_right Article , Journal 2021Publisher:American Chemical Society (ACS) Jingyi Yang; Xiaoyuan Lin; Na Xing; Zhao Zhang; Haiwei Zhang; Haibo Wu; Weiwei Xue;pmid: 34279924
The continual spread of novel coronavirus disease 2019 (COVID-19) is caused by severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2), posing a severe threat to the health worldwide. The main protease (Mpro, alias 3CLpro) of SARS-CoV-2 is a crucial enzyme for the maturation of viral particles and is a very attractive target for designing drugs to treat COVID-19. Here, we propose a multiple conformation-based virtual screening strategy to discover inhibitors that can target SARS-CoV-2 Mpro. Based on this strategy, nine Mpro structures and a protein mimetics library with 8960 commercially available compounds were prepared to carry out ensemble docking for the first time. Five of the nine structures are apo forms presented in different conformations, whereas the other four structures are holo forms complexed with different ligands. The surface plasmon resonance assay revealed that 6 out of 49 compounds had the ability to bind to SARS-CoV-2 Mpro. The fluorescence resonance energy transfer experiment showed that the biochemical half-maximal inhibitory concentration (IC50) values of the six compounds could hamper Mpro activities ranged from 0.69 ± 0.05 to 2.05 ± 0.92 μM. Evaluation of antiviral activity using the cell-based assay indicated that two compounds (Z1244904919 and Z1759961356) could strongly inhibit the cytopathic effect and reduce replication of the living virus in Vero E6 cells with the half-maximal effective concentrations (EC50) of 4.98 ± 1.83 and 8.52 ± 0.92 μM, respectively. The mechanism of the action for the two inhibitors were further elucidated at the molecular level by molecular dynamics simulation and subsequent binding free energy analysis. As a result, the discovered noncovalent reversible inhibitors with novel scaffolds are promising antiviral drug candidates, which may be used to develop the treatment of COVID-19.
Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 1753License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)Smithsonian figshareArticle . 1753License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)Journal of Chemical Information and ModelingArticle . 2021 . Peer-reviewedLicense: https://doi.org/10.15223/policy-001Data sources: Crossrefadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acs.jcim.1c00355&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.euAccess Routesbronze 61 citations 61 popularity Top 1% influence Top 10% impulse Top 1% Powered by BIP!
more_vert Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 1753License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)Smithsonian figshareArticle . 1753License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)Journal of Chemical Information and ModelingArticle . 2021 . Peer-reviewedLicense: https://doi.org/10.15223/policy-001Data sources: Crossrefadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acs.jcim.1c00355&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eudescription Publicationkeyboard_double_arrow_right Article , Other literature type 2021Publisher:American Chemical Society (ACS) Authors: Itisha Dwivedi; Chandramouli Subramaniam;Soft graphitizable carbon-based multifunctional nanomaterials have found versatile applications ranging from energy storage to quantum computing. In contrast, their hard-carbon analogues have been poorly investigated from both fundamental and application-oriented perspectives. The predominant challenges have been (a) the lack of approaches to fabricate porous hard-carbons and (b) their thermally nongraphitizable nature, leading to inaccessibility for several potential applications. In this direction, we present design principles for fabrication of porous hard-carbon-based nanostructured carbon florets (NCFs) with a highly accessible surface area (∼936 m2/g), rivalling their soft-carbon counterparts. Subjecting such thermally stable hard-carbons to a synergistic combination of an electric field and Joule heating drives their transformation to free-standing macroscopic monoliths composed of onion-like carbons (OLCMs). This represents the first such structural transformation observed in sp2-based hard-carbon NCFs to sp2-networked OLCMs. Micro-Raman spectroscopy establishes the simultaneous increase in the intensity of D-, 2D-, and D + G-bands at 1341, 2712, and 2936 cm-1 and is correlated to the reorganization in the disordered graphitic domains of NCFs to curved concentric nested spheres in OLCMs. This therefore completely precludes the formation of a nanodiamond core that has been consistently observed in all previously reported OLCs. The Joule heating-driven formation of OLCMs is accompanied by ∼5700% enhancement in electrical conductivity that is brought about by the fusion of outermost graphitic shells of OLCs to result in monolithic OLC structures (OLCMs). The porous and inter-networked OLCMs exhibit an excellent adsorption-based capture of volatile organic compounds such as toluene at high efficiencies (∼99%) over a concentration range (0.22-1.86 ppm) that is relevant for direct applications such as smoke filters in cigarettes.
Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)add ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acsmaterialsau.1c00062&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.euAccess RoutesGreen gold 13 citations 13 popularity Top 10% influence Average impulse Top 10% Powered by BIP!
more_vert Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)add ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acsmaterialsau.1c00062&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eudescription Publicationkeyboard_double_arrow_right Article , Other literature type 2021Publisher:American Chemical Society (ACS) Authors: Itisha Dwivedi; Chandramouli Subramaniam;Soft graphitizable carbon-based multifunctional nanomaterials have found versatile applications ranging from energy storage to quantum computing. In contrast, their hard-carbon analogues have been poorly investigated from both fundamental and application-oriented perspectives. The predominant challenges have been (a) the lack of approaches to fabricate porous hard-carbons and (b) their thermally nongraphitizable nature, leading to inaccessibility for several potential applications. In this direction, we present design principles for fabrication of porous hard-carbon-based nanostructured carbon florets (NCFs) with a highly accessible surface area (∼936 m2/g), rivalling their soft-carbon counterparts. Subjecting such thermally stable hard-carbons to a synergistic combination of an electric field and Joule heating drives their transformation to free-standing macroscopic monoliths composed of onion-like carbons (OLCMs). This represents the first such structural transformation observed in sp2-based hard-carbon NCFs to sp2-networked OLCMs. Micro-Raman spectroscopy establishes the simultaneous increase in the intensity of D-, 2D-, and D + G-bands at 1341, 2712, and 2936 cm-1 and is correlated to the reorganization in the disordered graphitic domains of NCFs to curved concentric nested spheres in OLCMs. This therefore completely precludes the formation of a nanodiamond core that has been consistently observed in all previously reported OLCs. The Joule heating-driven formation of OLCMs is accompanied by ∼5700% enhancement in electrical conductivity that is brought about by the fusion of outermost graphitic shells of OLCs to result in monolithic OLC structures (OLCMs). The porous and inter-networked OLCMs exhibit an excellent adsorption-based capture of volatile organic compounds such as toluene at high efficiencies (∼99%) over a concentration range (0.22-1.86 ppm) that is relevant for direct applications such as smoke filters in cigarettes.
Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)add ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acsmaterialsau.1c00062&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.euAccess RoutesGreen gold 13 citations 13 popularity Top 10% influence Average impulse Top 10% Powered by BIP!
more_vert Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)add ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acsmaterialsau.1c00062&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eudescription Publicationkeyboard_double_arrow_right Article 2021Authors: Angus W. Naylor (11502419); James D. Ford (6095315); Tristan Pearce (4620556); David Fawcett (11502422); +2 AuthorsAngus W. Naylor (11502419); James D. Ford (6095315); Tristan Pearce (4620556); David Fawcett (11502422); Dylan Clark (11502425); James van Alstine (11502428);(DOCX)
Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BYData sources: Bielefeld Academic Search Engine (BASE)add ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=base_search_::d4acba308aad0f9f8e0066c91e0ba1ef&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eu0 citations 0 popularity Average influence Average impulse Average Powered by BIP!
more_vert Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BYData sources: Bielefeld Academic Search Engine (BASE)add ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=base_search_::d4acba308aad0f9f8e0066c91e0ba1ef&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eudescription Publicationkeyboard_double_arrow_right Article 2021Authors: Angus W. Naylor (11502419); James D. Ford (6095315); Tristan Pearce (4620556); David Fawcett (11502422); +2 AuthorsAngus W. Naylor (11502419); James D. Ford (6095315); Tristan Pearce (4620556); David Fawcett (11502422); Dylan Clark (11502425); James van Alstine (11502428);(DOCX)
Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BYData sources: Bielefeld Academic Search Engine (BASE)add ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=base_search_::d4acba308aad0f9f8e0066c91e0ba1ef&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eu0 citations 0 popularity Average influence Average impulse Average Powered by BIP!
more_vert Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BYData sources: Bielefeld Academic Search Engine (BASE)add ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=base_search_::d4acba308aad0f9f8e0066c91e0ba1ef&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eudescription Publicationkeyboard_double_arrow_right Article , Journal 2021Embargo end date: 26 Jul 2021 Spain, Switzerland, SpainPublisher:American Chemical Society (ACS) Sebastiano Carlo D’Angelo; Selene Cobo; Victor Tulus; Abhinandan Nabera; Antonio José Martín; Javier Pérez-Ramírez; Gonzalo Guillén-Gosálbez;handle: 10902/33795
At present, the synthesis of ammonia through the Haber-Bosch (HB) process accounts for 1.2% of the global carbon emissions, representing roughly one-fourth of the global fossil consumption from the chemical industry, which creates a pressing need for alternative low-carbon synthesis routes. Analyzing seven essential planetary boundaries (PBs) for the safe operation of our planet, we find that the standard HB process is unsustainable as it vastly transgresses the climate change PB. In order to identify more responsible strategies from this integrated perspective, we assess the absolute sustainability level of 34 alternative routes where hydrogen (H-2) is supplied by steam methane reforming with carbon capture and storage, biomass gasification, or water electrolysis powered by various energy sources. We found that some of these scenarios could substantially reduce the global impact of fossil HB, yet alleviating the impact on climate change could critically exacerbate the impacts on other Earth-system processes. Furthermore, we identify that reducing the cost of electrolytic H-2 is the main avenue toward the economic appeal of the most sustainable routes. Our work highlights the need to embrace global impacts beyond climate change in the assessment of decarbonization routes of fossil chemicals. This approach enabled us to identify more suitable alternatives and associated challenges toward environmental and economically attractive ammonia synthesis. ACS Sustainable Chemistry & Engineering, 9 (29) ISSN:2168-0485
Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)ACS Sustainable Chemistry & EngineeringArticle . 2021 . Peer-reviewedLicense: CC BYData sources: CrossrefRecolector de Ciencia Abierta, RECOLECTAArticle . 2024License: CC BYData sources: Recolector de Ciencia Abierta, RECOLECTAadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acssuschemeng.1c01915&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.euAccess RoutesGreen hybrid 61 citations 61 popularity Top 10% influence Top 10% impulse Top 1% Powered by BIP!
visibility 196visibility views 196 download downloads 25 Powered bymore_vert Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)ACS Sustainable Chemistry & EngineeringArticle . 2021 . Peer-reviewedLicense: CC BYData sources: CrossrefRecolector de Ciencia Abierta, RECOLECTAArticle . 2024License: CC BYData sources: Recolector de Ciencia Abierta, RECOLECTAadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acssuschemeng.1c01915&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eudescription Publicationkeyboard_double_arrow_right Article , Journal 2021Embargo end date: 26 Jul 2021 Spain, Switzerland, SpainPublisher:American Chemical Society (ACS) Sebastiano Carlo D’Angelo; Selene Cobo; Victor Tulus; Abhinandan Nabera; Antonio José Martín; Javier Pérez-Ramírez; Gonzalo Guillén-Gosálbez;handle: 10902/33795
At present, the synthesis of ammonia through the Haber-Bosch (HB) process accounts for 1.2% of the global carbon emissions, representing roughly one-fourth of the global fossil consumption from the chemical industry, which creates a pressing need for alternative low-carbon synthesis routes. Analyzing seven essential planetary boundaries (PBs) for the safe operation of our planet, we find that the standard HB process is unsustainable as it vastly transgresses the climate change PB. In order to identify more responsible strategies from this integrated perspective, we assess the absolute sustainability level of 34 alternative routes where hydrogen (H-2) is supplied by steam methane reforming with carbon capture and storage, biomass gasification, or water electrolysis powered by various energy sources. We found that some of these scenarios could substantially reduce the global impact of fossil HB, yet alleviating the impact on climate change could critically exacerbate the impacts on other Earth-system processes. Furthermore, we identify that reducing the cost of electrolytic H-2 is the main avenue toward the economic appeal of the most sustainable routes. Our work highlights the need to embrace global impacts beyond climate change in the assessment of decarbonization routes of fossil chemicals. This approach enabled us to identify more suitable alternatives and associated challenges toward environmental and economically attractive ammonia synthesis. ACS Sustainable Chemistry & Engineering, 9 (29) ISSN:2168-0485
Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)ACS Sustainable Chemistry & EngineeringArticle . 2021 . Peer-reviewedLicense: CC BYData sources: CrossrefRecolector de Ciencia Abierta, RECOLECTAArticle . 2024License: CC BYData sources: Recolector de Ciencia Abierta, RECOLECTAadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acssuschemeng.1c01915&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.euAccess RoutesGreen hybrid 61 citations 61 popularity Top 10% influence Top 10% impulse Top 1% Powered by BIP!
visibility 196visibility views 196 download downloads 25 Powered bymore_vert Smithsonian figshare arrow_drop_down Smithsonian figshareArticle . 2021License: CC BY NCData sources: Bielefeld Academic Search Engine (BASE)ACS Sustainable Chemistry & EngineeringArticle . 2021 . Peer-reviewedLicense: CC BYData sources: CrossrefRecolector de Ciencia Abierta, RECOLECTAArticle . 2024License: CC BYData sources: Recolector de Ciencia Abierta, RECOLECTAadd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1021/acssuschemeng.1c01915&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eudescription Publicationkeyboard_double_arrow_right Article , Other literature type , Journal 2021Publisher:Informa UK Limited Funded by:EC | STRENTEXEC| STRENTEXAuthors: Ali, Adnan E.; Jeoti, Varun; Stojanović, Goran M.;Wearable power supply devices and systems are important necessities for the emerging textile electronic applications. Current energy supply devices usually need more space than the device they power, and are often based on rigid and bulky materials, making them difficult to wear. Fabric-based batteries without any rigid electrical components are therefore ideal candidates to solve the problem of powering these devices. Printing technologies have greater potential in manufacturing lightweight and low-cost batteries with high areal capacity and generating high voltages which are crucial for electronic textile (e-textile) applications. In this review, we present various printing techniques, and battery chemistries applied for smart fabrics, and give a comparison between them in terms of their potential to power the next generation of electronic textiles. Series combinations of many of these printed and distributed battery cells, using electrically conducting threads, have demonstrated their ability to power different electronic devices with a specific voltage and current requirements. Therefore, the present review summarizes the chemistries and material components of several flexible and textile-based batteries, and provides an outlook for the future development of fabric-based printed batteries for wearable and electronic textile applications with enhanced level of DC voltage and current for long periods of time.
Science and Technolo... arrow_drop_down Science and Technology of Advanced MaterialsArticle . Peer-reviewedLicense: CC BYData sources: SygmaSmithsonian figshareArticle . 2021License: CC BYData sources: Bielefeld Academic Search Engine (BASE)Science and Technology of Advanced MaterialsArticle . 2021 . Peer-reviewedLicense: CC BYData sources: CrossrefScience and Technology of Advanced MaterialsArticle . 2021 . Peer-reviewedData sources: European Union Open Data Portaladd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1080/14686996.2021.1962203&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.euAccess RoutesGreen gold 23 citations 23 popularity Top 10% influence Average impulse Top 10% Powered by BIP!
more_vert Science and Technolo... arrow_drop_down Science and Technology of Advanced MaterialsArticle . Peer-reviewedLicense: CC BYData sources: SygmaSmithsonian figshareArticle . 2021License: CC BYData sources: Bielefeld Academic Search Engine (BASE)Science and Technology of Advanced MaterialsArticle . 2021 . Peer-reviewedLicense: CC BYData sources: CrossrefScience and Technology of Advanced MaterialsArticle . 2021 . Peer-reviewedData sources: European Union Open Data Portaladd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1080/14686996.2021.1962203&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eudescription Publicationkeyboard_double_arrow_right Article , Other literature type , Journal 2021Publisher:Informa UK Limited Funded by:EC | STRENTEXEC| STRENTEXAuthors: Ali, Adnan E.; Jeoti, Varun; Stojanović, Goran M.;Wearable power supply devices and systems are important necessities for the emerging textile electronic applications. Current energy supply devices usually need more space than the device they power, and are often based on rigid and bulky materials, making them difficult to wear. Fabric-based batteries without any rigid electrical components are therefore ideal candidates to solve the problem of powering these devices. Printing technologies have greater potential in manufacturing lightweight and low-cost batteries with high areal capacity and generating high voltages which are crucial for electronic textile (e-textile) applications. In this review, we present various printing techniques, and battery chemistries applied for smart fabrics, and give a comparison between them in terms of their potential to power the next generation of electronic textiles. Series combinations of many of these printed and distributed battery cells, using electrically conducting threads, have demonstrated their ability to power different electronic devices with a specific voltage and current requirements. Therefore, the present review summarizes the chemistries and material components of several flexible and textile-based batteries, and provides an outlook for the future development of fabric-based printed batteries for wearable and electronic textile applications with enhanced level of DC voltage and current for long periods of time.
Science and Technolo... arrow_drop_down Science and Technology of Advanced MaterialsArticle . Peer-reviewedLicense: CC BYData sources: SygmaSmithsonian figshareArticle . 2021License: CC BYData sources: Bielefeld Academic Search Engine (BASE)Science and Technology of Advanced MaterialsArticle . 2021 . Peer-reviewedLicense: CC BYData sources: CrossrefScience and Technology of Advanced MaterialsArticle . 2021 . Peer-reviewedData sources: European Union Open Data Portaladd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1080/14686996.2021.1962203&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.euAccess RoutesGreen gold 23 citations 23 popularity Top 10% influence Average impulse Top 10% Powered by BIP!
more_vert Science and Technolo... arrow_drop_down Science and Technology of Advanced MaterialsArticle . Peer-reviewedLicense: CC BYData sources: SygmaSmithsonian figshareArticle . 2021License: CC BYData sources: Bielefeld Academic Search Engine (BASE)Science and Technology of Advanced MaterialsArticle . 2021 . Peer-reviewedLicense: CC BYData sources: CrossrefScience and Technology of Advanced MaterialsArticle . 2021 . Peer-reviewedData sources: European Union Open Data Portaladd ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.1080/14686996.2021.1962203&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eudescription Publicationkeyboard_double_arrow_right Other literature type , Article 2021Publisher:figshare Authors: Laur, Celia; Corrado, Ann Marie; Grimshaw, Jeremy M.; Ivers, Noah;Additional file 1. Interview Guide.
add ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.6084/m9.figshare.14361317.v1&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.euAccess RoutesGreen 0 citations 0 popularity Average influence Average impulse Average Powered by BIP!
more_vert add ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.6084/m9.figshare.14361317.v1&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.eudescription Publicationkeyboard_double_arrow_right Other literature type , Article 2021Publisher:figshare Authors: Laur, Celia; Corrado, Ann Marie; Grimshaw, Jeremy M.; Ivers, Noah;Additional file 1. Interview Guide.
add ClaimPlease grant OpenAIRE to access and update your ORCID works.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.This Research product is the result of merged Research products in OpenAIRE.
You have already added works in your ORCID record related to the merged Research product.All Research productsarrow_drop_down <script type="text/javascript"> <!-- document.write('<div id="oa_widget"></div>'); document.write('<script type="text/javascript" src="https://beta.openaire.eu/index.php?option=com_openaire&view=widget&format=raw&projectId=10.6084/m9.figshare.14361317.v1&type=result"></script>'); --> </script>
For further information contact us at helpdesk@openaire.euAccess RoutesGreen 0 citations 0 popularity Average influence Average impulse Average Powered by BIP!
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