A computational study of the negative LiIn modified anode and its interaction with β-Li3PS4 solid–electrolyte for battery applications
Copyright policy )A computational study of the negative LiIn modified anode and its interaction with β-Li3PS4 solid–electrolyte for battery applications
DFT was applied to study the LiIn surfaces' formation and structural stability in interfaces with β-Li3PS4. The stable interfaces established with the β-Li3PS4 featured favorable adhesion energy, low strain energy, and little reconstruction.
- University of Turin Italy
- University of Eastern Piedmont Amadeo Avogadro Italy
- Jaume I University Spain
- Jaume I University Spain
Commercial materials, Computation theory, All-solid-state lithium battery, Lithium alloys, Computational studies, Binary alloys, 540, Interface property, 530, Li metal, Bulk properties, Energy density, Lithium batteries, Battery applications, Adhesion, Density functional theory, Solid electrolytes, Structural stabilities, Stability, Strain energy
Commercial materials, Computation theory, All-solid-state lithium battery, Lithium alloys, Computational studies, Binary alloys, 540, Interface property, 530, Li metal, Bulk properties, Energy density, Lithium batteries, Battery applications, Adhesion, Density functional theory, Solid electrolytes, Structural stabilities, Stability, Strain energy
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