Theoretical Study of Lithium Ionic Conductors by Electronic Stress Tensor Density and Electronic Kinetic Energy Density

Hiroo Nozaki, Yosuke Fujii, Kazuhide Ichikawa +3

We analyze the electronic structure of lithium ionic conductors, $\mathrm{L}{\mathrm{i}}_3\mathrm{P}{\mathrm{O}}_4$ and $\mathrm{L}{\mathrm{i}}_3\mathrm{P}{\mathrm{S}}_4$, using the electronic stress tensor density and kinetic energy density with s…