Hydrogen Clathrate Structures in Rare Earth Hydrides at High Pressures: Possible Route to Room-Temperature Superconductivity

Observation of the Wigner-Huntington transition to metallic hydrogen

(2017) Ranga P. Dias et al.   SCIENCE

Materials discovery at high pressures

(2017) Lijun Zhang et al.   Nature Reviews Materials

High-Pressure Phase Stability and Superconductivity of Pnictogen Hydrides and Chemical Trends for Compressed Hydrides

(2016) Yuhao Fu et al.   CHEMISTRY OF MATERIALS

Evidence for a new phase of dense hydrogen above 325 gigapascals

(2016) Philip Dalladay-Simpson et al.   NATURE

Conventional superconductivity at 203 kelvin at high pressures in the sulfur hydride system

(2015) A. P. Drozdov et al.   NATURE

Superconductivity in compressed hydrogen-rich materials: Pressing on hydrogen

(2015) Viktor V. Struzhkin   PHYSICA C-SUPERCONDUCTIVITY AND ITS APPLICATIONS

Pressure-induced decomposition of solid hydrogen sulfide

(2015) Defang Duan et al.   PHYSICAL REVIEW B

High-Pressure Hydrogen Sulfide from First Principles: A Strongly Anharmonic Phonon-Mediated Superconductor

(2015) Ion Errea et al.   PHYSICAL REVIEW LETTERS

Phase Diagram and High-Temperature Superconductivity of Compressed Selenium Hydrides

(2015) Shoutao Zhang et al.   Scientific Reports

Pressure-stabilized superconductive yttrium hydrides

(2015) Yinwei Li et al.   Scientific Reports

Metallization and superconductivity of BeH2 under high pressure

(2014) Ziwei Wang et al.   JOURNAL OF CHEMICAL PHYSICS

The metallization and superconductivity of dense hydrogen sulfide

(2014) Yinwei Li et al.   JOURNAL OF CHEMICAL PHYSICS

Properties of the pressure-induced superconducting state in trihydrides ScH3and LaH3

(2014) A P Durajski et al.   SUPERCONDUCTOR SCIENCE & TECHNOLOGY

Pressure-induced metallization of dense (H2S)2H2 with high-T c superconductivity

(2014) Defang Duan et al.   Scientific Reports

Superconductivity of lithium-doped hydrogen under high pressure

(2014) Yu Xie et al.   Acta Crystallographica Section C-Structural Chemistry

Metallization of magnesium polyhydrides under pressure

(2013) David C. Lonie et al.   PHYSICAL REVIEW B

CALYPSO: A method for crystal structure prediction

(2012) Yanchao Wang et al.   COMPUTER PHYSICS COMMUNICATIONS

Lattice contraction of cerium hydrides from first-principles LDA + U calculations

(2012) B.Y. Ao et al.   INTERNATIONAL JOURNAL OF HYDROGEN ENERGY

A fresh look at dense hydrogen under pressure. I. An introduction to the problem, and an index probing equalization of H–H distances

(2012) Vanessa Labet et al.   JOURNAL OF CHEMICAL PHYSICS

Ab initiostudy revealing a layered structure in hydrogen-rich KH6under high pressure

(2012) Dawei Zhou et al.   PHYSICAL REVIEW B

Cagelike Diamondoid Nitrogen at High Pressures

(2012) Xiaoli Wang et al.   PHYSICAL REVIEW LETTERS

Superconductive sodalite-like clathrate calcium hydride at high pressures

(2012) H. Wang et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Crystal Orbital Hamilton Population (COHP) Analysis As Projected from Plane-Wave Basis Sets

(2011) Volker L. Deringer et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Ab initiorandom structure searching

(2011) Chris J Pickard et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

Cold melting and solid structures of dense lithium

(2011) Christophe L. Guillaume et al.   Nature Physics

High-temperature superconductivity in atomic metallic hydrogen

(2011) Jeffrey M. McMahon et al.   PHYSICAL REVIEW B

Predicted Novel High-Pressure Phases of Lithium

(2011) Jian Lv et al.   PHYSICAL REVIEW LETTERS

Ground-State Structures of Atomic Metallic Hydrogen

(2011) Jeffrey M. McMahon et al.   PHYSICAL REVIEW LETTERS

Substitutional Alloy of Bi and Te at High Pressure

(2011) Li Zhu et al.   PHYSICAL REVIEW LETTERS

High pressure partially ionic phase of water ice

(2011) Yanchao Wang et al.   Nature Communications

Crystal structure prediction via particle-swarm optimization

(2010) Yanchao Wang et al.   PHYSICAL REVIEW B

High-pressure crystal structures and superconductivity of Stannane (SnH4)

(2010) G. Gao et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Superconductivity at  100 K in dense SiH4(H2)2 predicted by first principles

(2010) Y. Li et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials

(2009) Paolo Giannozzi et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

Novel Structures and Superconductivity of Silane under Pressure

(2009) Miguel Martinez-Canales et al.   PHYSICAL REVIEW LETTERS

A little bit of lithium does a lot for hydrogen

(2009) E. Zurek et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

First-principles calculations of the ferroelastic transition between rutile-type andCaCl2-typeSiO2at high pressures

(2008) Atsushi Togo et al.   PHYSICAL REVIEW B

Superconducting High Pressure Phase of Germane

(2008) Guoying Gao et al.   PHYSICAL REVIEW LETTERS

Ab InitioDescription of High-Temperature Superconductivity in Dense Molecular Hydrogen

(2008) P. Cudazzo et al.   PHYSICAL REVIEW LETTERS