ChemInform Abstract: Evaluation of Tavorite‐Structured Cathode Materials for Lithium‐Ion Batteries Using High‐Throughput Computing. |
| |
| Authors: | Tim Mueller Geoffroy Hautier Anubhav Jain Gerbrand Ceder |
| |
| Abstract: | Tavorite‐structured oxyphosphates, fluorophosphates, oxysulfates, and fluorosulfates are evaluated for use as cathode materials in lithium ion batteries and activation energies for lithium diffusion through LiVO(PO4), LiV(PO4)F, and LiFe(SO4)F are calculated. |
| |
| Keywords: | theory of the condensed state potentials, cells, elements (inorganic) lithium, Li transition metals phosphorus, P silicon, Si |
|
|
