Yan Cheng

发表

Equation of state and transport properties of warm dense helium via quantum molecular dynamics simulations

Zhi-Guo Li, Yan Cheng, Qi-Feng Chen, 2016 .

First-principles calculations for structures and absorption optical spectra of sulfur cluster S7

Jun Zhu, Xiao-lin Zhou, Yan Cheng, 2004 .

Pressure effect on electronic, elastic and optical properties of Eu:CaF2 crystal: a first-principles study

G. Ji, Yan Cheng, Yuanhua Qi, 2015 .

Possible lower energy isomer of carbon clusters C (n = 11, 12) via particle swarm optimization algorithm: Ab initio investigation

Jun Zhu, G. Ji, Yan Cheng, 2019, Chemical Physics Letters.

Ab initio investigation of structure, spectrum, aromaticity and electronic properties of C 10 carbon cluster

Yan Cheng, Qi-Feng Chen, Xiang-Rong Chen, 2017 .

The structural phase transition of ammonia borane under high pressure

G. Ji, Yan Cheng, Yongkai Wei, 2020 .

Structural and elastic properties of orthorhombic CaGeO3 under pressure from first principles

Yan Cheng, Xiang-rong Chen, L. Cai, 2013 .

Penta-PdX2 (X = S, Se, Te) monolayers: promising anisotropic thermoelectric materials

Yan Cheng, Qi-Feng Chen, Xiang-Rong Chen, 2019, Journal of Materials Chemistry A.

Lattice dynamics and thermal conductivity of calcium fluoride via first-principles investigation

D. Wei, Yan Cheng, Xiang-Rong Chen, 2016 .

Probing the structural and electronic properties of boron cluster anions doped with one or two aluminum atoms

Xiang-dong Yang, Yan Cheng, Chenju Wang, 2014 .

Ab initio study of cationic water cluster (H2O)9+ via particle swarm optimization algorithm

Yan Cheng, Xiang-Rong Chen, Lan-Ting Shi, 2017 .

Ab initio investigation of the lower energy candidate structures for (H₂O)₅⁺ water cluster.

Yan Cheng, Xiang-Rong Chen, L. Cai, 2014, The Journal of chemical physics.

Spin-Filtering Transport in Double Parallel Quantum Wires on a Graphene Sheet

Yan Cheng, Xiang-Rong Chen, Fu-Ti Liu, 2015 .

Effect of spin-flip scattering on the electron transport through double quantum dots

Yan Cheng, Fu-Bin Yang, Rui Huang, 2015 .

Density function theory study of electronic, optical and thermodynamic properties of CaN2, SrN2 and BaN2

Yan Cheng, Shitao Xu, Li-Qin Zhang, 2017, Journal of Wuhan University of Technology-Mater. Sci. Ed..

Pressure effects on structural, elastic and electronic properties of BaZnO2: first-principles study

Yi-xian Wang, G. Ji, Yan Cheng, 2015 .

Structural, electronic and elastic properties of AlFe2B2: First-principles study

Yan Cheng, Xiang-Rong Chen, L. Cai, 2014 .

Spin-dependent Fano resonance in an impurity-doped graphene coupled to ferromagnetic leads

Yan Cheng, Fu-Ti Liu, Fu-Bin Yang, 2013 .

Structural, elastic, electronic and optical properties of double perovskites Ba2NaXO6 (X = Cl, Br, I): First-principles study

G. Ji, Yan Cheng, Cui-E. Hu, 2023, Materials Science in Semiconductor Processing.

First principles study of electronic, bonding, elastic properties and intrinsic hardness of CdSiP2

G. Ji, Yan Cheng, Xiang-rong Chen, 2013 .

Structural and elastic properties of Ce2O3 under pressure from LDA+U method

Yan Cheng, Yuanhua Qi, Cai Cheng, 2013, Frontiers of Physics.

Electronic, elastic and thermal properties of SrCu2As2 via first principles calculation

G. Ji, Yan Cheng, Xiang-rong Chen, 2013 .

Molecular dynamics studies of body-centered cubic tungsten during melting under pressure

Chao Xu, Yan Cheng, Xiang-Rong Chen, 2017 .

Investigations on the structural, elastic and electronic properties of the orthorhombic Zirconium–Nickel alloy under different pressure

Wen Chen, Mi-An Xue, Xiaoli Yuan, 2012 .

Elastic stability and electronic structure of tantalum boride investigated via first-principles density functional calculations

Yan Bi, G. Ji, Yan Cheng, 2012 .

First-principles investigations on elastic, thermodynamic and lattice thermal conductivity of topological insulator LaAs

Yan Cheng, Qi-Feng Chen, Xiang-rong Chen, 2018 .

Structural, elastic, thermodynamic, electronic properties and phase transition in half-Heusler alloy NiVSb at high pressures

G. Ji, Yan Cheng, L. Cai, 2015 .

First principles investigations on elastic and electronic properties of BaHfN2 under pressure

G. Ji, Yan Cheng, Xiang-rong Chen, 2012 .

Elastic and electronic properties of Ce2O3 from first principles

G. Ji, Yan Cheng, Xiang-rong Chen, 2013 .

Elastic and electronic properties of MnTi2O4 under pressure: A first-principle study

G. Ji, Yan Cheng, Xiang-Rong Chen, 2014 .

First-principles study of structural, elastic, and electronic properties of CeB6 under pressure

G. Ji, Yan Cheng, M. Tang, 2015 .

First-principles study of structural, elastic, and electronic properties of CeB6 under pressure

G. Ji, Yan Cheng, M. Tang, 2015, Frontiers of Physics.

Physical properties of osmium dinitride with fluorite, pyrite, marcasite, and monoclinic structures under high pressure: First-principles study

G. Ji, Yan Cheng, Yongkai Wei, 2015 .

First-principles calculations for elastic and electronic properties of ZnSnO 3 under pressure

G. Ji, Yan Cheng, Xiang-rong Chen, 2011 .

Pressure effects on elastic and thermodynamic properties of Zr3Al intermetallic compound

G. Ji, Z. Gong, D. Wei, 2012 .

Elastic, electronic and thermal properties of topological insulator SmB6: first-principles calculations

G. Ji, Yan Cheng, Cui-E. Hu, 2017 .

Structural and elastic properties of Mg B 2 under high pressure

Wenjun Zhu, Yan Cheng, Xiang-rong Chen, 2005 .

First-principles calculations of structural, electronic, magnetic, elastic and optical properties of tetragonal zircon-type CeVO4

Yan Cheng, Y. Mu, Cui-E. Hu, 2018, International Journal of Modern Physics B.

Structural, elastic and electronic properties of CeVO4 via first-principles calculations

G. Ji, Yan Cheng, Min Liu, 2013 .

First-principles study of the phonon vibrational spectra and thermal properties of hexagonal MoS2

Yan Cheng, Qing Lu, Jiaonan Yuan, 2015 .

Ab initio study for the intermolecular interaction potential surface of Ar-N2 complex

Yan Cheng, You Lu, Jin Zhu, 2005 .

The effect of vacancies on melting properties of tantalum via molecular dynamics simulations

Chao Xu, Yan Cheng, Chaoren Liu, 2015 .

Elastic and thermodynamic properties of CaB6 under pressure from first principles

G. Ji, Yan Cheng, Yongkai Wei, 2011 .

First-principles investigations on elastic, phonon and thermodynamic properties of SrB6 under pressure

G. Ji, Yan Cheng, Xingbin Pan, 2012 .

Structural exploration and properties of (H 2 O) 4 + cluster via ab initio in combination with particle swarm optimization method

Yan Cheng, Xiang-Rong Chen, L. Cai, 2015 .

First-principles study of structural, elastic, electronic and thermodynamic properties of topological insulator Bi2Se3 under pressure

G. Ji, Yan Cheng, Xiang Gao, 2016 .

First-principles study of structural, elastic, electronic and thermodynamic properties of topological insulator Sb2Te3 under pressure

Yan Cheng, Mei Tang, G. Ji, 2015 .

Comparative study on structural, elastic, dynamical, and thermodynamic properties of Weyl semimetals MX (M = Ta or Nb; X = As or P)

G. Ji, Yan Cheng, Zhao-Qi Wang, 2017 .

First-Principles Study of Electronic and Elastic Properties of Hexagonal Layered Crystal MoS2 Under Pressure

Yan Cheng, Xiang-Rong Chen, Jiaonan Yuan, 2015 .

Transition phase and thermodynamic properties of GaN via first-principles calculations

Yan Cheng, Xiang-rong Chen, Lai-Yu Lu, 2005 .

Melting curves and structural properties of tantalum from the modified-Z method

Chao Xu, Yan Cheng, Chaoren Liu, 2015 .

The Melting Curves and Entropy of Iron under High Pressure

F. Jing, F. Luo, Yan Cheng, 2011 .

Phase transition and thermodynamic properties of beryllium from first-principles calculations

F. Luo, Yan Cheng, Zhi-cheng Guo, 2014 .

PHASE TRANSITION, ELASTIC AND THERMODYNAMIC PROPERTIES OF BERYLLIUM VIA FIRST PRINCIPLES

G. Ji, Yan Cheng, Hai-Hua Chen, 2013 .

Ab initio investigation of cationic water cluster (H2O)13+ via particle swarm optimization algorithm

Yan Cheng, Cui-E. Hu, Shuai-Kang Zhang, 2019, Theoretical Chemistry Accounts.

Elastic Properties and Electronic Structure of WS2 under Pressure from First-principles Calculations

Yan Cheng, M. Tang, Zhao-Yi Zeng, 2017 .

First-principles studies on the structural, electronic and thermal transport characteristics of half-Heusler compounds LiXN (X=Mg, Zn)

Yan Cheng, Cui-E. Hu, Tian Zhang, 2023, Solid State Communications.

First-principles calculation of structural stability, lattice dynamic and thermodynamic properties of BeX (X = S, Se and Te) compounds under high pressure

F. Luo, G. Ji, Yan Cheng, 2015 .

Electronic transport properties of silicon carbide molecular junctions: first-principles study

Yan Cheng, Xiang-Rong Chen, Y. Mu, 2016 .

Quantum transport of Au-S-S-Au nanoscale junctions

S. Sanvito, Yan Cheng, Xiang-rong Chen, 2012 .

Quantum conductance oscillation in linear monatomic silicon chains

Yan Cheng, Fu-Ti Liu, Fu-Bin Yang, 2014 .

Bias-dependent oscillatory electron transport of monatomic sulfur chains

S. Sanvito, Yan Cheng, Xiang-rong Chen, 2012 .

Bias-dependent conductance of Si 2 cluster

Yan Cheng, Fu-Ti Liu, Fu-Bin Yang, 2013 .

Structural, electronic, and elastic properties of CuFeS2: first-principles study

Yan Cheng, Xiang-Rong Chen, Xiang Gao, 2015 .

Ab initio investigation of structure, stability, polarizability, and electronic structure of Ga4As4 cluster

Yan Cheng, Xiang-Rong Chen, L. Cai, 2016 .

First-principles study of structures, elastic and optical properties of single-layer metal iodides under strain

R. Ran, G. Ji, Yan Cheng, 2020 .

First-Principles Study of Lattice Dynamics, Structural Phase Transition, and Thermodynamic Properties of Barium Titanate

Yan Cheng, Qing Lu, Zhao-Yi Zeng, 2016 .

Thermoelectric properties of Janus MXY (M = Pd, Pt; X, Y = S, Se, Te) transition-metal dichalcogenide monolayers from first principles

Jun Zhu, Yan Cheng, H. Geng, 2020 .

Electronic structure, optical properties, and phonon transport in Janus monolayer PtSSe via first-principles study

G. Ji, Yan Cheng, Y. Mu, 2019, Philosophical Magazine.

Dumbbell silicene: a strain-induced room temperature quantum spin Hall insulator

Yan Cheng, Xiang-Rong Chen, L. Cai, 2016 .

Ab initio calculations of quantum transport of Au-GaN-Au nanoscale junctions

Yan Cheng, Xiang-rong Chen, Tian Zhang, 2014 .

Robust large gap quantum spin Hall insulators in methyl and ethynyl functionalized TlSb buckled honeycombs

R. Ran, Yan Cheng, Qing Lu, 2018, Journal of Applied Physics.

First-principles study on band gaps and transport properties of van der Waals WSe2/WTe2 heterostructure

G. Ji, Yan Cheng, Cui-E. Hu, 2021 .

The effects of oxidation on the electronic, thermal and mechanical properties of antimonene: First-principles study

Yan Cheng, Qi-Feng Chen, Cui-E. Hu, 2019, Chemical Physics Letters.

Thermal transport properties of semimetal scandium antimonide: a first-principles study

Yan Cheng, H. Geng, Cui-E. Hu, 2021, Applied Physics A.

First-principles study of strain effect on elastic and optical properties and lattice thermal conductivity of Janus ZrBrCl monolayer

Zhi-yong Chen, Yan Cheng, H. Geng, 2021 .

Electronic Transport of (SiC)n (n = 1–4) Molecular Chains via First-Principles Calculations

Yan Cheng, Y. Mu, Zhao-Yi Zeng, 2017 .

Thermoelectric properties of strontium sulfide via first-principles calculations

Xiaowei Hou, Yan Cheng, H. Geng, 2020 .

Structural and thermodynamic properties of WB at high pressure and high temperature

F. Peng, Yan Bi, G. Ji, 2012 .

Structural exploration and properties of (BN)6 cluster via ab initio in combination with particle swarm optimization method

G. Ji, Yan Cheng, Cui-E. Hu, 2021, Theoretical Chemistry Accounts.

Orientation-dependent responses of tungsten single crystal under shock compression via molecular dynamics simulations

Chao Xu, Yan Cheng, L. Cai, 2015 .

Quantum transport through Ga2As2 cluster

Yan Cheng, Fu-Ti Liu, Fu-Bin Yang, 2014 .

Density-functional calculations of structures and absorption spectra of sulfur cluster S6

Jun Zhu, Yan Cheng, Xiang-rong Chen, 2005 .

Elastic and thermodynamic properties of c-BN from first-principles calculations

Yan Cheng, Xiang-rong Chen, Y. Hao, 2007 .

Elastic and thermodynamic properties of the zinc-blende structure LiZnN under pressure

Jun Zhu, Yan Cheng, Xiang-rong Chen, 2010 .

Phase transition and thermodynamic properties of CaF2 via first principles

Yan Cheng, Xiang-Rong Chen, Min Liu, 2013 .

Structure and thermodynamic properties of BeO: Empirical corrections in the quasiharmonic approximation

F. Luo, Yan Cheng, Xiang-Rong Chen, 2013 .

Structural, mechanical, thermodynamics properties and phase transition of FeVSb

Yan Cheng, Lin Zhang, B. Zhu, 2011 .

First principles calculation on quantum transport of Au-Si3-Au nanoscale junction

Yan Cheng, Fu-Ti Liu, Fu-Bin Yang, 2014 .

LDA+U calculation of structural and thermodynamic properties of Ce2O3

Yan Cheng, B. Zhu, Z. Niu, 2014 .

LDA+U calculation of structural and thermodynamic properties of Ce2O3

Yan Cheng, B. Zhu, Z. Niu, 2014, Frontiers of Physics.

First-Principles Study of the Structural, Optical, Dynamical and Thermodynamic Properties of BaZn$$\hbox {O}_{2}$$O2 Under Pressure

Yi-xian Wang, G. Ji, Yan Cheng, 2016 .

Lattice dynamics, phonon vibrational spectra, and thermal properties of tetragonal SrPt3P: a first-principles study

G. Ji, Yan Cheng, Zhao-Yi Zeng, 2016 .

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G. Ji, Yan Cheng, Huai-Yong Zhang, 2014, International Journal of Thermophysics.

Elastic, thermodynamic and electronic properties of LaF3 under pressure from first principles

G. Ji, Yan Cheng, Xiang-rong Chen, 2014 .

PHASE TRANSITION AND THERMODYNAMIC PROPERTIES OF MAGNESIUM FLUORIDE BY FIRST PRINCIPLES

G. Ji, Yan Cheng, Tian Zhang, 2014 .

First-Principles Investigations on Structural, Elastic, Dynamical, and Thermal Properties of Earth-Abundant Nitride Semiconductor CaZn2N2 under Pressure

Yan Cheng, L. Cai, Cui-E. Hu, 2016 .

Structural, thermodynamic and electronic properties of zinc-blende AlN from first-principles calculations

Wei Zhang, Jun Zhu, Yan Cheng, 2009 .

Electronic structure and thermodynamic properties of LiBC under high pressure

Z. Fu, Yan Cheng, Xiang-rong Chen, 2008 .

Size-dependent melting and coalescence of tungsten nanoclusters via molecular dynamics simulation.

Chao Xu, Yan Cheng, Xiang-Rong Chen, 2013, Physical chemistry chemical physics : PCCP.

First-principles study of elastic, thermal and optical properties of a metal-shrouded two-dimensional semiconductor Tl2O

Yan Cheng, Qi-Feng Chen, Zhao-Yi Zeng, 2019, Solid State Communications.

First-principles study of structural, electronic, elastic, vibrational and thermodynamics properties of LaX3 (X=Sn, Tl, Pb and Bi) compounds under pressure

Yan Cheng, Guangxing Ji, Cui-E. Hu, 2021 .

A possible superhard orthorhombic carbon

Yan Cheng, Xiang-Rong Chen, L. Cai, 2014 .

Spin-dependent transport through a quantum wire on a graphene surface

Yan Cheng, Fu-Ti Liu, Fu-Bin Yang, 2013 .

Thermodynamic and optical properties of CuAlO2 under pressure from first principle

G. Ji, Yan Cheng, Li-Qin Zhang, 2015, Journal of Wuhan University of Technology-Mater. Sci. Ed..

Structural and elastic properties of Ce2O3 under pressure from LDA+U method

Yan Cheng, Yuanhua Qi, Cai Cheng, 2013 .

Elastic and electronic properties of YNi2B2C under pressure from first principles

G. Ji, Yan Cheng, Chang-Ge Piao, 2012 .

Structural and elastic properties of LaTiO3 under pressure

G. Ji, Yan Cheng, N. Ge, 2011 .

Theoretical Calculations of Mechanical, Electronic, and Chemical Bonding in CaN2, SrN2, and BaN2

G. Ji, Yan Cheng, Chang-Ge Piao, 2014 .

Ab initio investigation of structure, stability, thermal behavior and infrared spectra of (BN)4 cluster

Yan Cheng, Cui-E. Hu, Lei Liu, 2018, Computational and Theoretical Chemistry.

Elastic Properties of Monoclinic $$\hbox {ZrO}_{2}$$ZrO2 at Finite Temperatures Via First Principles

Yan Cheng, Yuanhua Qi, Tian Zhang, 2014 .

Negative Differential Resistance of Au-MgB2-Au Nanoscale Junctions

Yan Cheng, Fu-Ti Liu, Xiang-rong Chen, 2014 .

Thermoelectric properties of Janus AsSBr monolayer from first-principles study

Yan Cheng, H. Geng, Cui-E. Hu, 2021, Solid State Communications.

First-Principles Study of Electronic, Elastic, and Optical Properties of Yb:CaF2 Crystals

G. Ji, Yan Cheng, Xiang-rong Chen, 2015 .

Elastic and electronic properties of cubic cerium oxide under pressure via first principles

G. Ji, Yan Cheng, R. Song, 2014 .

Electronic and thermoelectric properties of Janus AsSeX (X = Cl, Br, I) monolayers: A first-principles study

Yan Cheng, Cui-E. Hu, Tian Zhang, 2023, Materials Science in Semiconductor Processing.

First-principles investigation of structural, mechanical, electronic, and bonding properties of NaZnSb

Xiang-dong Yang, Yan Cheng, Chenju Wang, 2015, Frontiers of Physics.

Phase transition, dynamical and electronic properties of BeO: First-principles investigations

G. Ji, Yan Cheng, L. Cai, 2014 .

Structural, elastic, electronic and optical properties of platinum-based superconductor SrPt3P under pressure: a first-principles study

G. Ji, Yan Cheng, Guo-Jun Li, 2016 .

Elastic properties and phonon dispersions of rhenium in hexagonal-close-packed structure under pressure from first principles

G. Ji, Yan Cheng, Chang-Ge Piao, 2012 .

Phase transition, elastic and electronic properties of topological insulator Sb 2 Te 3 under pressure: First principle study

G. Ji, Yan Cheng, Qing Lu, 2016 .

Thermodynamic and Electronic Properties of OsB2from First-Principles Calculations

G. Ji, Yan Cheng, Yuelan Wang, 2014 .

Structural and thermodynamic properties of Os from first-principles calculations

G. Ji, Yan Cheng, B. Zhu, 2011 .

Thermodynamic properties of MgO under high pressure from first-principles calculations

Jun Zhu, Yan Cheng, Xiang-rong Chen, 2005 .

Pressure-driven change of ground state of Ce3Pd3Bi

G. Ji, Yan Cheng, Jun-Tao Zhu, 2022, Physical Review B.

First-Principles Study of Structure, Elastic Properties, and Thermal Conductivity of Monolayer Calcium Hydrobromide

Sirui Li, Yan Cheng, Cui-E. Hu, 2021 .

Elastic and electronic properties of LiBSi2 under pressure from first principles

G. Ji, Yan Cheng, Min Liu, 2014 .

First-Principles Investigations on Structural, Elastic, and Thermodynamic Properties of Ce-La Alloys Under High Pressure

G. Ji, Yan Cheng, Z. Niu, 2014 .

Thermodynamic properties of OsB under high temperature and high pressure

Yan Bi, Yan Cheng, L. Cai, 2011 .

First-principles calculations for structure and equation of state of MgB2 at high pressure

Yan Cheng, Xiang-rong Chen, Y. Hao, 2005 .

Thermodynamic and Electronic Properties of OsB2from First-Principles Calculations

G. Ji, Yan Cheng, Yuelan Wang, 2014 .