Concepedia

Ab initio studies of structural and electronic properties of Li4Ti5O12 spinel

Chuying Ouyang, Ziyi Zhong

Electrochemistry Communications · 2007 · 277 citations · 16 references

DOI

Concepts

References

16

Special points for Brillouin-zone integrations

Hendrik J. Monkhorst, J.D. Pack · Physical review. B, Solid state · 1976 · 70.3K citations

, , +6

Soft self-consistent pseudopotentials in a generalized eigenvalue formalism

David Vanderbilt · Physical review. B, Condensed matter · 1990 · 22.9K citations

, , +13

Atoms, molecules, solids, and surfaces: Applications of the generalized gradient approximation for exchange and correlation

John P. Perdew, J. A. Chevary, S. H. Vosko et al. · Physical review. B, Condensed matter · 1992 · 22K citations

, , +16

Iterative minimization techniques for<i>ab initio</i>total-energy calculations: molecular dynamics and conjugate gradients

M. C. Payne, M. P. Teter, D. C. Allan et al. · Reviews of Modern Physics · 1992 · 9.6K citations

, , +16

Zero‐Strain Insertion Material of Li [ Li1 / 3Ti5 / 3 ]  O 4 for Rechargeable Lithium Cells

Tsutomu Ohzuku, Atsushi Ueda, Norihiro Yamamoto · Journal of The Electrochemical Society · 1995 · 1.9K citations

, , +14