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List of works by Yanming Ma

A Protocol to Fabricate Nanostructured New Phase: B31-Type MnS Synthesized under High Pressure

scientific article published on 5 August 2015

A Stable, Magnetic, and Metallic Li3O4 Compound as a Discharge Product in a Li-Air Battery

scientific article published on 11 July 2014

A hidden symmetry-broken phase of MoS2 revealed as a superior photovoltaic material

article by Meiling Xu et al published 2018 in Journal of Materials Chemistry A

A hypervalent and cubically coordinated molecular phase of IF predicted at high pressure

scientific article published on 03 January 2019

A new phase of solid iodine with different molecular covalent bonds

scientific article

A novel low compressible and superhard carbon nitride: body-centered tetragonal CN2.

scientific article published in October 2012

A two-dimensional TiB4 monolayer exhibits planar octacoordinate Ti.

scientific article published on 13 November 2017

ATLAS: A real-space finite-difference implementation of orbital-free density functional theory ⬇️

Ab initio electronic structure calculations using a real-space Chebyshev-filtered subspace iteration method

scientific article published on 17 June 2019

Ab initio prediction of superconductivity in molecular metallic hydrogen under high pressure

Ab initio studies of solid bromine under high pressure

scientific article

Accelerating CALYPSO structure prediction by data-driven learning of a potential energy surface

scientific article published on 01 October 2018

An automated predictor for identifying transition states in solids

scientific article published on 12 March 2020

An effective structure prediction method for layered materials based on 2D particle swarm optimization algorithm

scientific article

Anatase (101)-like Structural Model Revealed for Metastable Rutile TiO2(011) Surface.

scientific article published on 23 February 2017

Anomalous Melting Behavior of Solid Hydrogen at High Pressures

Anomalous Stress Response of Ultrahard WB_{n} Compounds.

scientific article published on 29 October 2015

Author Correction: Ferromagnetic quasi-atomic electrons in two-dimensional electride

scientific article published on 14 May 2020

B38: an all-boron fullerene analogue

scientific article published on 04 July 2014

CALYPSO structure prediction method

article published in 2015

CALYPSO structure prediction method and its wide application

CaCl2-type high-pressure phase of magnesium hydride predicted by ab initio phonon calculations

scholarly article by Lijun Zhang et al published 23 April 2007 in Physical Review B

Cagelike diamondoid nitrogen at high pressures

scientific article published on 24 October 2012

Calculated high-pressure structural properties, lattice dynamics and quasi particle band structures of perovskite fluorides KZnF3, CsCaF3 and BaLiF3. ⬇️

scientific article published on 14 June 2016

Carbon coated face-centered cubic Ru–C nanoalloys

scientific article published on 01 September 2014

Carbon-in-Al4C3 nanowire superstructures for field emitters

scientific article published on 13 January 2011

Catenation of carbon in LaC2 predicted under high pressure

scientific article published on 11 May 2016

ChemInform Abstract: Ionic High-Pressure Form of Elemental Boron

Chemical bonding, electron-phonon coupling, and structural transformations in high-pressure phases of Si.

scientific article published in March 2006

Chemically Tuning Stability and Superconductivity of P-H Compounds

scientific article published on 22 January 2020

Coexistence of superconductivity and electride states in Ca<sub>2</sub>H with an antifluorite-type motif under compression

scientific article published in January 2023

Comment on "Pressure-dependent metallic and superconducting phases in a germanium artificial metal"

scientific article published on 02 April 2010

Computational discovery and characterization of new B2O phases

scientific article published on 01 January 2019

Computer-Assisted Design of a Superior Be2BO3F Deep-Ultraviolet Nonlinear-Optical Material.

scientific article published on 27 April 2018

Computer-Assisted Inverse Design of Inorganic Electrides

Construction of crystal structure prototype database: methods and applications

scientific article

Correction: Erratum: Materials discovery at high pressures

scholarly article published in Nature reviews. Materials

Crystal Structures and Electronic Properties of Oxygen-rich Titanium Oxides at High Pressure.

scientific article published on 2 March 2018

Crystalline LiN5 Predicted from First-Principles as a Possible High-Energy Material

scientific article published on 9 June 2015

Data-driven prediction of complex crystal structures of dense lithium

scientific article published on 22 May 2023

Design of Superhard Ternary Compounds under High Pressure: SiC2N4 and Si2CN4

Design of ternary alkaline-earth metal Sn(ii) oxides with potential good p-type conductivity ⬇️

Determinations of the high-pressure crystal structures of Sb2Te3

scientific article published on October 31, 2012

Dissociation of methane under high pressure.

scientific article published on October 2010

Dissociation products and structures of solidH2Sat strong compression ⬇️

scholarly article in Physical Review B, vol. 93 no. 2, January 2016

Effects of manganese doping on the structure evolution of small-sized boron clusters

scientific article

Electronic structures, lattice dynamics, and electron–phonon coupling of simple cubic Ca under pressure

article

Erratum: Ionic high-pressure form of elemental boron

scientific article published in Nature

Evidence for an emergent anomalous metallic state in compressed titanium

scientific article published on 24 April 2023

Evolutionary Crystal Structure Prediction and Novel High-Pressure Phases

Evolutionary Crystal Structure Prediction as a Method for the Discovery of Minerals and Materials

scientific article published in 2010

Exotic Hydrogen Bonding in Compressed Ammonia Hydrides

scientific article published on 13 May 2019

Exotic behavior and crystal structures of calcium under pressure

scientific article

Experimental Observation of the High Pressure Induced Substitutional Solid Solution and Phase Transformation in SbS

scientific article published in Scientific Reports

Experimental clathrate superhydrides EuH 6 and EuH 9 at extreme pressure conditions

scientific article published on 12 November 2021

Extraordinary Indentation Strain Stiffening Produces Superhard Tungsten Nitrides.

scientific article published on 15 September 2017

Ferromagnetic quasi-atomic electrons in two-dimensional electride

scientific article published on 23 March 2020

First-principle optimal local pseudopotentials construction via optimized effective potential method

scientific article published on 01 April 2016

First-principles prediction on the high-pressure structures of transition metal diborides (TMB2, TM = Sc, Ti, Y, Zr)

scientific article published on 01 August 2010

First-principles structural design of superhard materials

scientific article published in March 2013

First-principles studies of structural and electronic properties of hexagonalBC5

scholarly article in Physical Review B, vol. 73 no. 21, June 2006

First-principles study of electron-phonon coupling in hole- and electron-doped diamonds in the virtual crystal approximation

scholarly article in Physical Review B, vol. 72 no. 1, July 2005

First-principles study of the lattice dynamics, thermodynamic properties and electron-phonon coupling ofYB6

scholarly article in Physical Review B, vol. 76 no. 21, December 2007

First-principles study of the magnetic, structural and electronic properties of LiFeAs

scientific article published on 12 January 2010

First-principles study of the pressure-induced rutile–CaCl2 phase transition in MgF2

article published in 2008

Global structural optimization of tungsten borides

scientific article published on 27 March 2013

Globally stable structures of LixZn (x = 1-4) compounds at high pressures.

scientific article published on 21 January 2016

Gluing together metallic and covalent layers to form Ru2C under ambient conditions.

scientific article

Gold as a 6p-Element in Dense Lithium Aurides.

scientific article

Gold with +4 and +6 Oxidation States in AuF4 and AuF6

scientific article published on 23 July 2018

Ground-State Crystal Structure of Strontium Peroxide Predicted from First Principles.

scientific article published on 9 June 2017

HgTe: a potential thermoelectric material in the cinnabar phase.

scientific article published on May 2008

High pressure partially ionic phase of water ice

scientific article published in Nature Communications

High pressure structures of "111" type iron-based superconductors predicted from first-principles

scientific article published on 04 October 2012

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

scholarly article by Yuhao Fu et al published 29 February 2016 in Chemistry of Materials

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

scientific article

High-pressure hydrogen sulfide from first principles: a strongly anharmonic phonon-mediated superconductor. ⬇️

scientific article published on 16 April 2015

High-pressure phase transformations in CaH2

High-pressure phase transition of cesium chloride and cesium bromide.

scientific article published in September 2014

High-pressure phase transitions of solid HF, HCl, and HBr: Anab initioevolutionary study

scholarly article in Physical Review B, vol. 82 no. 1, July 2010

High-pressure polymorphs of Li(2)BeH(4) predicted by first-principles calculations

scientific article published on 27 August 2009

High-pressure strengthening in ultrafine-grained metals

scientific article published on 24 February 2020

High-pressure structural transitions of Sc2O3 by X-ray diffraction, Raman spectra, and ab initio calculations

scientific article published on 01 September 2009

Hybrid functional study rationalizes the simple cubic phase of calcium at high pressures

scientific article published on 01 November 2012

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

scientific article published on 8 September 2017

Hydrogen segregation and its roles in structural stability and metallization: silane under pressure

scientific article

Influence of pressure and impurity hydrogen on the elastic property of metal lithium

article published in 2007

Insights into Enhanced Visible-Light Photocatalytic Hydrogen Evolution of g-C3N4 and Highly Reduced Graphene Oxide Composite: The Role of Oxygen

scholarly article by Liang Xu et al published 18 February 2015 in Chemistry of Materials

Interactions in Nb_2H and its electronic structure

article published in 2007

Investigations on structural determination of semi-transition-metal borides.

scientific article published on 27 November 2017

Ionic high-pressure form of elemental boron

scientific article

IrF8 Molecular Crystal under High Pressure

scientific article published on 21 March 2019

Lattice instability and martensitic transformation in LaAg predicted from first-principles theory

scientific article published in February 2012

Local Carbon Concentration Determines the Graphene Edge Structure

scientific article published on 16 April 2020

Magnetism in Na-filled Fe-based skutterudites

scientific article published on June 2015

Materials discovery at high pressures

Materials discovery via CALYPSO methodology

scientific article published on 29 April 2015

Mercury under Pressure acts as a Transition Metal: Calculated from First Principles.

scientific article

Metallic icosahedron phase of sodium at terapascal pressures ⬇️

scientific article published on 23 March 2015

Metallization and superconductivity of BeH2 under high pressure.

scientific article published in March 2014

Modulated structure and molecular dissociation of solid chlorine at high pressures.

scientific article published in August 2012

Nanocrystalline tungsten hydrides at high pressures

Nanotwinned diamond with unprecedented hardness and stability

scientific article published in Nature

Nitrogen Backbone Oligomers

scientific article published on 19 August 2015

Novel high pressure structures and superconductivity of CaLi2

scientific article published on 29 April 2010

Novel high pressure structures of polymeric nitrogen.

scientific article

Novel high-pressure structures of MgCO3, CaCO3 and CO2 and their role in Earth's lower mantle

scholarly article

Novel phases in ammonia-water mixtures under pressure

scientific article published on 01 December 2018

Novel structures and superconductivity of silane under pressure

scientific article published on 27 February 2009

O(NlogN) scaling method to evaluate the ion-electron potential of crystalline solids. ⬇️

scientific article

One-Dimensional Al4O4C Ceramics: A New Type of Blue Light Emitter

scientific article

Open questions on the high-pressure chemistry of the noble gases

scientific article published on 4 February 2022

Order-disorder phase transition and dissociation of hydrogen sulfide under high pressure: ab initio molecular dynamics study

scientific article published on 01 April 2010

Ordering of hydrogen bonds in high-pressure low-temperature H2O

scientific article published on 19 January 2005

Oxygen-doped boron nitride nanosheets with excellent performance in hydrogen storage

Particle-swarm structure prediction on clusters.

scientific article published in August 2012

Peierls transition in sodium under high pressure: a first-principles study

scientific article published on 11 December 2008

Perspective: crystal structure prediction at high pressures.

scientific article published on January 2014

Phase Diagram and High-Temperature Superconductivity of Compressed Selenium Hydrides

scientific article

Phase Transitions in Light Elements under Pressure

article published in 2011

Phase stability and mechanical properties of tungsten borides from first principles calculations

scientific article published on 27 August 2010

Phonon and elastic instabilities in rocksalt alkali hydrides under pressure: First-principles study

scholarly article in Physical Review B, vol. 75 no. 10, March 2007

Phonon instabilities in rocksalt AgCl and AgBr under pressure studied within density functional theory

scholarly article in Physical Review B, vol. 74 no. 5, August 2006

Predicted lithium-boron compounds under high pressure.

scientific article published on 2 November 2012

Predicted novel high-pressure phases of lithium

scientific article published on 07 January 2011

Predicting the structure and stability of titanium oxide electrides

scientific article published in December 2018

Predicting two-dimensional boron-carbon compounds by the global optimization method

scientific article published on 19 September 2011

Prediction of Host-Guest Na-Fe Intermetallics at High Pressures

scientific article published on 24 June 2016

Prediction of silicon-based layered structures for optoelectronic applications.

scientific article published on 29 October 2014

Pressure stabilization of long-missing bare C6 hexagonal rings in binary sesquicarbides

Pressure-Stabilized Semiconducting Electrides in Alkaline-Earth-Metal Subnitrides

scientific article published on 12 September 2017

Pressure-driven phase transitions and reduction of dimensionality in 2D silicon nanosheets

scientific article published in Nature Communications

Pressure-induced amorphization in mayenite (12CaO·7Al2O3)

Pressure-induced enhancement of electron-phonon coupling in superconductingCaC6from first principles

scholarly article in Physical Review B, vol. 74 no. 18, November 2006

Pressure-induced superconductivity in the nonsymmorphic topological insulator KHgAs

scientific article published on 6 October 2023

Pressure-stabilized divalent ozonide CaO3 and its impact on Earth's oxygen cycles

scientific article published on 17 September 2020

Pressure-stabilized superconductive yttrium hydrides

scientific article published on 5 May 2015

Progress on hydrogen-rich superconductors under high pressure

Properties and order-disorder competition of spin-1/2 XY model in the ferrimagnetic diamond chain

article published in 2012

Proton or deuteron transfer in phase IV of solid hydrogen and deuterium

scientific article published on 09 January 2013

Publisher’s Note: Computer-Assisted Inverse Design of Inorganic Electrides [Phys. Rev. X 7 , 011017 (2017)]

Quantum behavior of a hydrogen atom in metal Nb

article published in 2008

Quantum hydrogen-bond symmetrization in the superconducting hydrogen sulfide system ⬇️

scientific article published on 28 March 2016

Quasi-Molecular and Atomic Phases of Dense Solid Hydrogen

article published in 2012

Rare Helium-Bearing Compound FeO_{2}He Stabilized at Deep-Earth Conditions

scientific article published on 01 December 2018

Reactions of xenon with iron and nickel are predicted in the Earth's inner core

scientific article published on 20 April 2014

Report on the sixth blind test of organic crystal structure prediction methods

scientific article

Robust Diffusive Proton Motions in Phase IV of Solid Hydrogen

Room-temperature ferromagnetism of 2H-SiC-α-Al2O3 solid solution nanowires and the physical origin

scientific article published on 01 March 2015

Room-temperature structures of solid hydrogen at high pressures

scientific article published on 01 August 2012

Route to a Superconducting Phase above Room Temperature in Electron-Doped Hydride Compounds under High Pressure

scientific article published on 01 August 2019

Route to high-energy density polymeric nitrogen t-N via He-N compounds.

scientific article published on 19 February 2018

Scandium-doped AlN 1D hexagonal nanoprisms: a class of room-temperature ferromagnetic materials

scientific article published on 01 January 2010

Self-assembled ultrathin nanotubes on diamond (100) surface

scientific article published on 16 April 2014

Sequestration of helium and xenon via iron-halide compounds in early Earth

scientific article published on 27 March 2024

Silicon Framework-Based Lithium Silicides at High Pressures

scientific article published on 24 June 2016

Smooth Flow in Diamond: Atomistic Ductility and Electronic Conductivity

scientific article published on 01 November 2019

Sn(II)-Containing Phosphates as Optoelectronic Materials ⬇️

Spiral chain O₄ form of dense oxygen.

scientific article

Stability of H3O at extreme conditions and implications for the magnetic fields of Uranus and Neptune

scientific article published on 03 March 2020

Stabilization of H3+ in the high pressure crystalline structure of H n Cl (n = 2-7)

scientific article published on 21 October 2014

Stabilization of ammonia-rich hydrate inside icy planets

scientific article published on 07 August 2017

Stabilization of fullerene-like boron cages by transition metal encapsulation

scientific article published on 01 June 2015

Stable Lithium Argon compounds under high pressure.

scientific article

Structural and mechanical properties of platinum carbide.

scientific article published on 15 May 2014

Structural evolution of carbon dioxide under high pressure

scientific article published on 17 September 2013

Structural metatransition of energetically tangled crystalline phases.

scientific article

Structural morphologies of high-pressure polymorphs of strontium hydrides

scientific article published on 01 July 2015

Structural phase transformations of Mg(3)N(2) at high pressure: experimental and theoretical studies

scientific article published in October 2009

Structure searching methods: general discussion

Substitutional alloy of Bi and Te at high pressure

scientific article published on 08 April 2011

Superconducting high pressure phase of germane

scientific article published on 03 September 2008

Superconducting high-pressure phases of disilane

scientific article

Superconductive sodalite-like clathrate calcium hydride at high pressures

scientific article published on 6 April 2012

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

scientific article

Superconductivity in Pristine 2H_{a}-MoS_{2} at Ultrahigh Pressure

scientific article published in January 2018

Superhard BC(3) in cubic diamond structure.

scientific article published on 6 January 2015

Superhard Monoclinic Polymorph of Carbon

scientific article

Superhard and superconductive polymorphs of diamond-like BC3

scholarly article by Hanyu Liu et al published January 2011 in Physics Letters

Superhard polymorphs of diamond-like

Synthesis and high-pressure transformation of metastable wurtzite-structured CuGaS2 nanocrystals

scientific article published on 01 December 2012

Tellurium Hydrides at High Pressures: High-Temperature Superconductors

scientific article published on 4 February 2016

Tetragonal allotrope of group 14 elements

scientific article published on 19 July 2012

The 2021 room-temperature superconductivity roadmap

scholarly article

The anti-symmetric and anisotropic symmetric exchange interactions between electric dipoles in hafnia

scientific article published on 8 December 2023

The crystal structure and superconducting properties of monatomic bromine

scientific article published on 08 December 2009

The exotically stoichiometric compounds in Al–S system under high pressure

scientific article published on 04 February 2020

The influence of defects on the transport properties of AgSbPb18Te20prepared at high pressure and high temperature

The metallization and superconductivity of dense hydrogen sulfide

scientific article

Theoretical design of two-dimensional AMInP<sub>2</sub>X<sub>3</sub>Y<sub>3</sub> (AM = Li, Na, K; X/Y = S, Se, Te) monolayers for highly efficient excitonic solar cells

scientific article published in January 2023

Theoretical study of the ground-state structures and properties of niobium hydrides under pressure

scholarly article by Guoying Gao et al published 12 November 2013 in Physical Review B

Theory-orientated discovery of high-temperature superconductors in superhydrides stabilized under high pressure

scientific article published in November 2020

Tian et al. reply

scientific article published in October 2013

Transparent dense sodium

scientific article published in March 2009

Tuning optical properties of transparent conducting barium stannate by dimensional reduction ⬇️

Two dimensional Dirac carbon allotropes from graphene

scientific article published on 01 January 2014

Two-Dimensional C4N Global Minima: Unique Structural Topologies and Nanoelectronic Properties

Two-dimensional boron–nitrogen–carbon monolayers with tunable direct band gaps

scientific article published on 26 June 2015

Two-dimensional silicon monolayers generated on c-BN(111) substrate.

scientific article published on 2 June 2015

Twofold coordinated ground-state and eightfold high-pressure phases of heavy transition metal nitrides MN(2) (M = Os, Ir, Ru, and Rh)

scientific article published on 01 October 2009

Ultrahard nanotwinned cubic boron nitride.

scientific article

Unexpected Semimetallic BiS at High Pressure and High Temperature

scientific article published on 20 September 2018

Unexpected Trend in Stability of Xe-F Compounds under Pressure Driven by Xe-Xe Covalent Bonds

scientific article published on 24 October 2016

Unexpected room-temperature ferromagnetism in nanostructured Bi2Te3.

scientific article

Valence band x-ray emission spectra of compressed germanium

scientific article published on 06 April 2006

Water- and acid-stable self-passivated dihafnium sulfide electride and its persistent electrocatalytic reaction

scientific article published on 05 June 2020

Xenon iron oxides predicted as potential Xe hosts in Earth's lower mantle

scientific article published on 16 October 2020

Zeeman spin splittings with persistent spin textures in antiferromagnetic semiconductors

scientific article published on 5 September 2023

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