Biased interface between solid ion conductor LiBH4 and lithium metal: A first principles molecular dynamics study

Molecular dynamics investigation of the disordered crystal structure of hexagonal LiBH4

(2013) Philippe C. Aeberhard et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Ab initio molecular dynamics study of the Helmholtz layer formed on solid–liquid interfaces and its capacitance

(2012) Yasunobu Ando et al.   CHEMICAL PHYSICS LETTERS

Ab initioNonequilibrium Molecular Dynamics in the Solid Superionic ConductorLiBH4

(2012) Philippe C. Aeberhard et al.   PHYSICAL REVIEW LETTERS

The charged interface between Pt and water: First principles molecular dynamics simulations

(2012) Tamio Ikeshoji et al.   AIP Advances

Fast-ionic conductivity of Li+in LiBH4

(2011) Tamio Ikeshoji et al.   PHYSICAL REVIEW B

BH4−Self-Diffusion in Liquid LiBH4

(2010) Pascal Martelli et al.   JOURNAL OF PHYSICAL CHEMISTRY A

First-Principles Determination of the Ground-State Structure ofLiBH4

(2010) Adem Tekin et al.   PHYSICAL REVIEW LETTERS

Diffuse and doubly split atom occupation in hexagonal LiBH4

(2009) Tamio Ikeshoji et al.   APPLIED PHYSICS LETTERS

Stabilization of lithium superionic conduction phase and enhancement of conductivity of LiBH4 by LiCl addition

(2009) Motoaki Matsuo et al.   APPLIED PHYSICS LETTERS

First-principles determination of the ground-state structure of Mg(BH 4 ) 2

(2009) Riccarda Caputo et al.   CHEMICAL PHYSICS LETTERS

A grid-based Bader analysis algorithm without lattice bias

(2009) W Tang et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

Halide-Stabilized LiBH4, a Room-Temperature Lithium Fast-Ion Conductor

(2009) Hideki Maekawa et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Electrode Dynamics from First Principles

(2008) Minoru Otani et al.   JOURNAL OF THE PHYSICAL SOCIETY OF JAPAN

Predicting Enthalpies of Molecular Substances: Application toLiBH4

(2008) N. A. Zarkevich et al.   PHYSICAL REVIEW LETTERS