Nanosecond quantum molecular dynamics simulations of the lithium superionic conductorLi4−xGe1−xPxS4

Parametrization scheme with accuracy and transferability for tight-binding electronic structure calculations with extended Hückel approximation and molecular dynamics simulations

(2013) Shinya Nishino et al.   JOURNAL OF MOLECULAR MODELING

Anomalous High Ionic Conductivity of Nanoporous β-Li3PS4

(2013) Zengcai Liu et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Phase stability, electrochemical stability and ionic conductivity of the Li10±1MP2X12(M = Ge, Si, Sn, Al or P, and X = O, S or Se) family of superionic conductors

(2012) Shyue Ping Ong et al.   Energy & Environmental Science

Structural requirements for fast lithium ion migration in Li10GeP2S12

(2012) Stefan Adams et al.   JOURNAL OF MATERIALS CHEMISTRY

Direct Calculation of Li-Ion Transport in the Solid Electrolyte Interphase

(2012) Siqi Shi et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Computer Modeling of Crystalline Electrolytes: Lithium Thiophosphates and Phosphates

(2012) N. D. Lepley et al.   JOURNAL OF THE ELECTROCHEMICAL SOCIETY

Electronic structure calculations and quantum molecular dynamics simulations of the ionic liquid PP13–TFSI

(2012) Shinya Nishino et al.   SOLID STATE IONICS

First Principles Study of the Li10GeP2S12 Lithium Super Ionic Conductor Material

(2011) Yifei Mo et al.   CHEMISTRY OF MATERIALS

A lithium superionic conductor

(2011) Noriaki Kamaya et al.   NATURE MATERIALS

Computer modeling of lithium phosphate and thiophosphate electrolyte materials

(2010) N.A.W. Holzwarth et al.   JOURNAL OF POWER SOURCES

Crystal structure and phase transitions of the lithium ionic conductor Li3PS4

(2010) Kenji Homma et al.   SOLID STATE IONICS

Challenges for Rechargeable Li Batteries†

(2009) John B. Goodenough et al.   CHEMISTRY OF MATERIALS

The chemisorption of polyaromatic hydrocarbons on Si(100)H dangling bonds

(2008) F. Ample et al.   SURFACE SCIENCE