Data mining of molecular dynamics data reveals Li diffusion characteristics in garnet Li7La3Zr2O12

First-Principles Investigation of the Na+ Ion Transport Property in Oxyfluorinated Titanium(IV) Phosphate Na3Ti2P2O10F

(2016) Randy Jalem et al.   Journal of Physical Chemistry C

Sparse Cyclic Excitations Explain the Low Ionic Conductivity of StoichiometricLi7La3Zr2O12

(2016) Mario Burbano et al.   PHYSICAL REVIEW LETTERS

Finite-size effects on the molecular dynamics simulation of fast-ion conductors: A case study of lithium garnet oxide Li 7 La 3 Zr 2 O 12

(2016) Matthew J. Klenk et al.   SOLID STATE IONICS

Design and synthesis of the superionic conductor Na10SnP2S12

(2016) William D. Richards et al.   Nature Communications

High-power all-solid-state batteries using sulfide superionic conductors

(2016) Yuki Kato et al.   Nature Energy

Inorganic Solid-State Electrolytes for Lithium Batteries: Mechanisms and Properties Governing Ion Conduction

(2015) John Christopher Bachman et al.   CHEMICAL REVIEWS

Effects of Gallium Doping in Garnet-Type Li7La3Zr2O12 Solid Electrolytes

(2015) Randy Jalem et al.   CHEMISTRY OF MATERIALS

Phase transition in lithium garnet oxide ionic conductors Li 7 La 3 Zr 2 O 12 : The role of Ta substitution and H 2 O/CO 2 exposure

(2015) Yuxing Wang et al.   JOURNAL OF POWER SOURCES

Design principles for solid-state lithium superionic conductors

(2015) Yan Wang et al.   NATURE MATERIALS

Unraveling the effect of La A-site substitution on oxygen ion diffusion and oxygen catalysis in perovskite BaFeO3 by data-mining molecular dynamics and density functional theory

(2015) Chi Chen et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

A molecular dynamics study of oxygen ion diffusion in A-site ordered perovskite PrBaCo2O5.5: data mining the oxygen trajectories

(2015) Chi Chen et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Local structure and dynamics of lithium garnet ionic conductors: tetragonal and cubic Li7La3Zr2O7

(2015) Matthew Klenk et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Defect chemistry and lithium transport in Li3OCl anti-perovskite superionic conductors

(2015) Ziheng Lu et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Effects of penta- and trivalent dopants on structure and conductivity of Li7La3Zr2O12

(2015) W. Gu et al.   SOLID STATE IONICS

High-throughput design and optimization of fast lithium ion conductors by the combination of bond-valence method and density functional theory

(2015) Ruijuan Xiao et al.   Scientific Reports

All-solid-state lithium-oxygen battery with high safety in wide ambient temperature range

(2015) Hirokazu Kitaura et al.   Scientific Reports

Synergistic multi-doping effects on the Li7La3Zr2O12 solid electrolyte for fast lithium ion conduction

(2015) Dong Ok Shin et al.   Scientific Reports

Garnet-type solid-state fast Li ion conductors for Li batteries: critical review

(2014) Venkataraman Thangadurai et al.   CHEMICAL SOCIETY REVIEWS

Local Structure and Dynamics of Lithium Garnet Ionic Conductors: A Model Material Li5La3Ta2O12

(2014) Yuxing Wang et al.   CHEMISTRY OF MATERIALS

Solid-State Electrolytes: Revealing the Mechanisms of Li-Ion Conduction in Tetragonal and Cubic LLZO by First-Principles Calculations

(2014) Katharina Meier et al.   Journal of Physical Chemistry C

Relationships between Atomic Diffusion Mechanisms and Ensemble Transport Coefficients in Crystalline Polymorphs

(2014) Benjamin J. Morgan et al.   PHYSICAL REVIEW LETTERS

Concerted Migration Mechanism in the Li Ion Dynamics of Garnet-Type Li7La3Zr2O12

(2013) Randy Jalem et al.   CHEMISTRY OF MATERIALS

Effect of Rb and Ta Doping on the Ionic Conductivity and Stability of the Garnet Li7+2x–y(La3–xRbx)(Zr2–yTay)O12 (0 ≤ x ≤ 0.375, 0 ≤ y ≤ 1) Superionic Conductor: A First Principles Investigation

(2013) Lincoln J. Miara et al.   CHEMISTRY OF MATERIALS

Tetragonal Li10GeP2S12 and Li7GePS8 – exploring the Li ion dynamics in LGPS Li electrolytes

(2013) Alexander Kuhn et al.   Energy & Environmental Science

A sulphide lithium super ion conductor is superior to liquid ion conductors for use in rechargeable batteries

(2013) Yoshikatsu Seino et al.   Energy & Environmental Science

Effect of A-site cation disorder on oxygen diffusion in perovskite-type Ba0.5Sr0.5Co1−xFexO2.5

(2013) Hiromasa Shiiba et al.   Journal of Materials Chemistry A

Low temperature stabilization of cubic (Li7−xAlx/3)La3Zr2O12: role of aluminum during formation

(2013) Aude A. Hubaud et al.   Journal of Materials Chemistry A

Experimental visualization of lithium conduction pathways in garnet-type Li7La3Zr2O12

(2012) Jiantao Han et al.   CHEMICAL COMMUNICATIONS

Effect of substitution (Ta, Al, Ga) on the conductivity of Li7La3Zr2O12

(2012) J.L. Allen et al.   JOURNAL OF POWER SOURCES

Superionic Conductivity in Lithium-Rich Anti-Perovskites

(2012) Yusheng Zhao et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Mechanisms of Li+transport in garnet-type cubic Li3+xLa3M2O12(M= Te, Nb, Zr)

(2012) Ming Xu et al.   PHYSICAL REVIEW B

Origin of the Structural Phase Transition inLi7La3Zr2O12

(2012) N. Bernstein et al.   PHYSICAL REVIEW LETTERS

First Principles Study of the Li10GeP2S12 Lithium Super Ionic Conductor Material

(2011) Yifei Mo et al.   CHEMISTRY OF MATERIALS

Ion transport and phase transition in Li7−xLa3(Zr2−xMx)O12(M = Ta5+, Nb5+, x = 0, 0.25)

(2011) Stefan Adams et al.   JOURNAL OF MATERIALS CHEMISTRY

A lithium superionic conductor

(2011) Noriaki Kamaya et al.   NATURE MATERIALS

Structure and dynamics of the fast lithium ion conductor “Li7La3Zr2O12”

(2011) Henrik Buschmann et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

High lithium ionic conductivity in the garnet-type oxide Li7−X La3(Zr2−X, NbX)O12 (X=0–2)

(2010) Shingo Ohta et al.   JOURNAL OF POWER SOURCES

Inorganic solid Li ion conductors: An overview

(2009) Philippe Knauth   SOLID STATE IONICS