Evidence for anionic redox activity in a tridimensional-ordered Li-rich positive electrode β-Li2IrO3

A new active Li–Mn–O compound for high energy density Li-ion batteries

(2015) M. Freire et al.   NATURE MATERIALS

Unified theory of spiral magnetism in the harmonic-honeycomb iridatesα,β, andγLi2IrO3

(2015) Itamar Kimchi et al.   PHYSICAL REVIEW B

Hyperhoneycomb Iridateβ−Li2IrO3as a Platform for Kitaev Magnetism

(2015) T. Takayama et al.   PHYSICAL REVIEW LETTERS

High-capacity electrode materials for rechargeable lithium batteries: Li3NbO4-based system with cation-disordered rocksalt structure

(2015) Naoaki Yabuuchi et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Visualization of O-O peroxo-like dimers in high-capacity layered oxides for Li-ion batteries

(2015) E. McCalla et al.   SCIENCE

Origin of voltage decay in high-capacity layered oxide electrodes

(2014) M. Sathiya et al.   NATURE MATERIALS

Three-dimensional quantum spin liquids in models of harmonic-honeycomb iridates and phase diagram in an infinite-Dapproximation

(2014) Itamar Kimchi et al.   PHYSICAL REVIEW B

Unconventional magnetic order on the hyperhoneycomb Kitaev lattice inβ−Li2IrO3: Full solution via magnetic resonant x-ray diffraction

(2014) A. Biffin et al.   PHYSICAL REVIEW B

Realization of a three-dimensional spin–anisotropic harmonic honeycomb iridate

(2014) K. A. Modic et al.   Nature Communications

Polyanionic (Phosphates, Silicates, Sulfates) Frameworks as Electrode Materials for Rechargeable Li (or Na) Batteries

(2013) Christian Masquelier et al.   CHEMICAL REVIEWS

Sulfate-Based Polyanionic Compounds for Li-Ion Batteries: Synthesis, Crystal Chemistry, and Electrochemistry Aspects

(2013) G. Rousse et al.   CHEMISTRY OF MATERIALS

Reversible anionic redox chemistry in high-capacity layered-oxide electrodes

(2013) M. Sathiya et al.   NATURE MATERIALS

Effect of the damping function in dispersion corrected density functional theory

(2011) Stefan Grimme et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

ElAM: A computer program for the analysis and representation of anisotropic elastic properties

(2010) Arnaud Marmier et al.   COMPUTER PHYSICS COMMUNICATIONS

A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu

(2010) Stefan Grimme et al.   JOURNAL OF CHEMICAL PHYSICS

Building better batteries

(2008) M. Armand et al.   NATURE