Jihui Yang

发表

Jihui Yang, Jihui Yang, 2004 .

Design of I2–II–IV–VI4 Semiconductors through Element Substitution: The Thermodynamic Stability Limit and Chemical Trend

A. Walsh, X. Gong, Suhuai Wei, 2014 .

Structural diversity and electronic properties of Cu2SnX3 (X = S, Se): A first-principles investigation

A. Walsh, X. Gong, H. Xiang, 2011 .

Electronic structure and phase stability of MgTe, ZnTe, CdTe, and their alloys in the B3, B4, and B8 structures

A. Walsh, X. Gong, W. Yin, 2009 .

Design of Lead-Free Inorganic Halide Perovskites for Solar Cells via Cation-Transmutation.

Su-Huai Wei, Liping Yu, Yuhao Fu, 2017, Journal of the American Chemical Society.

Review on first-principles study of defect properties of CdTe as a solar cell absorber

W. Yin, Jie Ma, Ji-Sang Park, 2016 .

Enhanced p-type dopability of P and As in CdTe using non-equilibrium thermal processing

W. Metzger, W. Yin, T. Gessert, 2015 .

Effective band gap narrowing of anatase TiO2 by strain along a soft crystal direction

X. Gong, Yanfa Yan, W. Yin, 2010 .

First-principles study on the electronic and optical properties of cubic ABX3 halide perovskites

X. Gong, X. Gong, H. Xiang, 2013, 1309.0070.

Phosphorus Diffusion Mechanisms and Deep Incorporation in Polycrystalline and Single-Crystalline CdTe

S. Harvey, W. Metzger, D. Albin, 2016 .

NEGATIVE MAGNETORESISTANCE IN (INSB)1-XYX AT LOW TEMPERATURE

C. M. Thrush, J. Heremans, D. L. Partin, 1998 .

Strain field fluctuation effects on lattice thermal conductivity of ZrNiSn-based thermoelectric compounds

G. Meisner, Liu Chen, Jihui Yang, 2004 .

Origin of performance degradation in high-delithiation LixCoO2: insights from direct atomic simulations using global neural network potentials

C. Shang, Ji-Hui Yang, Zhipan Liu, 2022, Journal of Materials Chemistry A.

Prediction of ( TiO 2 ) x ( Cu 2 O ) y alloys for efficient photoelectrochemical water splitting †

A. Walsh, X. Gong, H. Xiang, 2012 .

Thermo-element geometry optimization for high thermoelectric efficiency

Yongjia Wu, Lei Zuo, Shikui Chen, 2018 .

Self-stopping effects of lithium penetration into silicon nanowires.

X. Gong, H. Xiang, R. Wu, 2013, Nanoscale.

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

Yanchao Wang, Yanming Ma, X. Gong, 2011, Journal of the American Chemical Society.

Wurtzite-derived polytypes of kesterite and stannite quaternary chalcogenide semiconductors

A. Walsh, X. Gong, Suhuai Wei, 2010 .

Origin of the superior conductivity of perovskite Ba(Sr)SnO3

X. Gong, H. Xiang, Ji-Hui Yang, 2012, 1209.2845.

Intrinsic point defects and complexes in the quaternary kesterite semiconductor Cu2ZnSnS4

A. Walsh, X. Gong, Suhuai Wei, 2010 .

Unusual interlayer coupling in layered Cu-based ternary chalcogenides CuMCh2 (M = Sb, Bi; Ch = S, Se).

X. Gong, Dangpo Wang, Jihui Yang, 2021, Nanoscale.

A New Multiferroic State with Large Electric Polarization in Tensile Strained TbMnO3

X. Gong, H. Xiang, Ji-Hui Yang, 2013, 1303.2167.

Thermoelectric Materials for Space and Automotive Power Generation

Thierry Caillat, T. Caillat, Jihui Yang, 2006 .

Automotive Applications of Thermoelectric Materials

Ji-Hui Yang, Francis R. Stabler, Jihui Yang, 2009 .

Rational Design of Advanced Thermoelectric Materials

Alex K.-Y. Jen, Hin-Lap Yip, A. Jen, 2013 .

Self-regulation of charged defect compensation and formation energy pinning in semiconductors

Ji-Hui Yang, W. Yin, Ji-Sang Park, 2015, Scientific Reports.

Defect‐Engineering‐Enabled High‐Efficiency All‐Inorganic Perovskite Solar Cells

J. Lou, Qing Ai, T. Terlier, 2019, Advanced materials.

Halide perovskite materials for solar cells: a theoretical review

Su-Huai Wei, Yanfa Yan, Joongoo Kang, 2015 .

Structural diversity and electronic properties of Cu 2 Sn X 3 ( X = S , Se ) : A first-principles investigation

A. Walsh, X. Gong, H. Xiang, 2011 .

Two-Level Quantum Systems in Two-Dimensional Materials for Single Photon Emission.

B. Yakobson, Sunny Gupta, Jihui Yang, 2018, Nano letters.

Defect properties of Sb- and Bi-doped CuInSe2: The effect of the deep lone-pair s states

K. Ramanathan, Ji-Sang Park, S. Wei, 2014 .

A first-principles investigation

Aron Walsh, Su-Huai Wei, Joongoo Kang, 2011 .

Dimensionality-Inhibited Chemical Doping in Two-Dimensional Semiconductors: The Phosphorene and MoS2 from Charge-Correction Method.

X. Gong, B. Yakobson, Yonggang Xu, 2021, Nano letters.

First-principles study of defect properties of zinc blende MgTe

X. Gong, H. Xiang, Ji-Hui Yang, 2011 .

Dimensionality-suppressed chemical doping in 2D semiconductors: the cases of phosphorene, MoS2, and ReS2 from first-principles

B. Yakobson, Jihui Yang, 2017, 1711.05094.

Fast self-diffusion of ions in CH3NH3PbI3: the interstiticaly mechanism versus vacancy-assisted mechanism

Ji-Hui Yang, W. Yin, Ji-Sang Park, 2016 .

What are grain boundary structures in graphene?

X. Gong, H. Xiang, Ji-Hui Yang, 2013, Nanoscale.

Efficient determination of the Hamiltonian and electronic properties using graph neural network with complete local coordinates

H. Xiang, Mao Su, X. Gong, 2022, Machine Learning: Science and Technology.

Exploring Large-Lattice-Mismatched Interfaces with Neural Network Potentials: The Case of the CdS/CdTe Heterostructure

Ji-Hui Yang, Mao Su, X. Gong, 2022, The Journal of Physical Chemistry C.

Earth-Abundant and Non-Toxic SiX (X=S, Se) Monolayers as Highly Efficient Thermoelectric Materials

B. Yakobson, Q. Yuan, Ji-Hui Yang, 2016, 1609.02832.

Surface stability and the selection rules of substrate orientation for optimal growth of epitaxial II-VI semiconductors

Yanfa Yan, W. Yin, T. Gessert, 2015 .

Compositional dependence of structural and electronic properties of Cu(2)ZnSn(S,Se)(4) alloys for thin film solar cells

A. Walsh, X. Gong, Ping Yang, 2011 .

Low Contact Barrier in 2H/1T' MoTe2 In-Plane Heterostructure Synthesized by Chemical Vapor Deposition.

P. Ajayan, R. Vajtai, J. Lai, 2019, ACS applied materials & interfaces.

Defect-assisted nonradiative recombination in Cu2ZnSnSe4 : A comparative study with Cu2ZnSnS4

X. Gong, Shiyou Chen, Yonggang Xu, 2021 .

Carrier providers or killers: The case of Cu defects in CdTe

W. Metzger, S. Wei, Jihui Yang, 2017, 1701.06068.

Non-Radiative Carrier Recombination Enhanced by Two-Level Process: A First-Principles Study

Lin Shi, Lin-Wang Wang, Ji-Hui Yang, 2016, Scientific Reports.

Abnormally weak intervalley electron scattering in MoS2 monolayer: insights from the matching between electron and phonon bands.

Ji-Hui Yang, Shiru Song, X. Gong, 2022, Nanoscale.

Excellent transverse power generation and cooling performances of artificially tilted thermoelectric film devices

Qingjie Zhang, Cuncheng Li, Wenyu Zhao, 2019 .

Polaron-enhanced giant strain effect on defect formation: The case of oxygen vacancies in rutile TiO2

X. Gong, Shiyou Chen, Yiyan Zheng, 2019, Physical review B.

Origin of off-stoichiometry and electrical benignity at the grain boundaries in CuInSe2: A first-principles study

X. Gong, Jihui Yang, G. Zhu, 2020, Journal of Applied Physics.

Rational Design of Two-Dimensional Magnetic Chromium Borides Based on First-Principles Calculation

X. Gong, H. Xiang, Yue-yu Zhang, 2021, Chinese Physics Letters.

Erratum: Wurtzite-derived polytypes of kesterite and stannite quaternary chalcogenide semiconductors [Phys. Rev. B 82 , 195203 (2010)]

A. Walsh, Shiyou Chen, Ye Luo, 2011 .

Chapter 21 Prospective Thermoelectrics among Topological Insulators

Ji-Hui Yang, Jihui Yang, 2016 .

Directly Determining the Interface Structure and Band Offset of a Large-Lattice-Mismatched CdS/CdTe Heterostructure

Zhipan Liu, Ji-Hui Yang, Quanyin Tang, 2020 .

Revised ab initio natural band offsets of all group IV, II-VI, and III-V semiconductors

A. Walsh, X. Gong, Jingbo Li, 2009 .

Exceptionally high phonon-limited carrier mobility in BX (X = P, As, Sb) monolayers

Ji-Hui Yang, Shiru Song, Shixuan Liu, 2022, 2204.11419.

Two-Dimensional SiS Layers with Promising Electronic and Optoelectronic Properties: Theoretical Prediction.

X. Gong, Suhuai Wei, B. Yakobson, 2016, Nano letters.

Polymerization of defect states at dislocation cores in InAs

W. McMahon, Joongoo Kang, Ji-Sang Park, 2016 .

Tuning the Fermi level beyond the equilibrium doping limit through quenching: The case of CdTe

Suhuai Wei, W. Metzger, Ji-Hui Yang, 2014 .

Anisotropic Infrared Response and Orientation-Dependent Strain-Tuning of the Electronic Structure in Nb2SiTe4.

Hugen Yan, Ji-Hui Yang, Jiamin Xue, 2022, ACS nano.

Enhancing Hole Density and Suppressing Recombination Centers through Illumination in Kesterite Thin Film Solar Cells.

Ji-Hui Yang, Xin-Gao Gong, Yonggang Xu, 2022, The journal of physical chemistry letters.

Stacking induced indirect-to-direct bandgap transition in layered group-IV monochalcogenides for ideal optoelectronics

X. Gong, Jihui Yang, 2019, Journal of Materials Chemistry C.

Cu-Zn disorder in stoichiometric and non-stoichiometric Cu2ZnSnS4/Cu2ZnSnSe4

X. Gong, Ji-Hui Yang, Yiyan Zheng, 2019, AIP Advances.

Stability and electronic structure of the low-Σ grain boundaries in CdTe: a density functional study

W. Metzger, Joongoo Kang, Ji-Sang Park, 2015 .

First-Principles Study of H+ Intercalation in Layer-Structured LiCoO2

X. Gong, Yongyao Xia, H. Xiang, 2011 .

Chemical Trends of Electronic Properties of Two-Dimensional Halide Perovskites and Their Potential Applications for Electronics and Optoelectronics

B. Yakobson, Q. Yuan, Jihui Yang, 2016 .

Van der Waals engineering of magnetism

H. Xiang, Jihui Yang, 2019, Nature Materials.

Unusual negative formation enthalpies and atomic ordering in isovalent alloys of transition metal dichalcogenide monolayers

B. Yakobson, Jihui Yang, 2017, 1710.05064.

Si3AlP: a new promising material for solar cell absorber.

X. Gong, H. Xiang, Ji-Hui Yang, 2012, Journal of the American Chemical Society.

Rapid fabrication and thermoelectric performance of SnTe via non-equilibrium laser 3D printing

C. Uher, Xinfeng Tang, Q. Zhang, 2018, Rare Metals.

Computational Study of the C2P4 Monolayer as a Stable Two-Dimensional Material with High Carrier Mobility: Implications for Nanoelectronic Devices

Jiayu Liang, Shiru Song, Mingchao Wang, 2022, ACS Applied Nano Materials.

General rules and applications for screening high phonon-limited mobility in two-dimensional semiconductors

Shiru Song, Shi Liu, X. Gong, 2023, Physical Review B.

Efficient prediction of density functional theory Hamiltonian with graph neural network

H. Xiang, Ji-Hui Yang, Xin-Gao Gong, 2022 .

Design of Two-Dimensional Graphene-like Dirac Materials β12-XBeB5 (X = H, F, Cl) from Non-graphene-like β12-Borophene.

S. Du, Hongjun Gao, B. Yakobson, 2017, The journal of physical chemistry letters.

Unusual defect properties in multivalent perovskite Cs2Au2I6 : A first-principles study

Pan Zhang, X. Gong, Jihui Yang, 2021, Physical Review Materials.

Lead-Free Double Perovskite Cs2 SnX6 : Facile Solution Synthesis and Excellent Stability.

J. Lou, Jia Liang, Ji-Hui Yang, 2019, Small.

Semiconducting α'-boron sheet with high mobility and low all-boron contact resistance: a first-principles study.

B. Yakobson, T. Altalhi, Jun-Jie Zhang, 2021, Nanoscale.

Origin of p-type conductivity in a WSe2 monolayer.

Jihui Yang, G. Zhu, Yu-Zhou Zhang, 2023, Nanoscale.

Self-consistently determining structures of charged defects and defect ionization energies in low-dimensional semiconductors

X. Gong, Jihui Yang, G. Zhu, 2020 .

Design of Two-Dimensional Graphene-like Dirac Materials β12-XBeB5 (X = H, F, Cl) from Non-graphene-like β12-Borophene.

S. Du, Hongjun Gao, B. Yakobson, 2017, The journal of physical chemistry letters.

First-principles studies of charged defect states in intrinsic ferromagnetic semiconductors: the case of monolayer CrI3

X. Gong, Yimei Fang, Yonggang Xu, 2023, New Journal of Physics.

Quaternary semiconductors with positive crystal field splitting: Potential high-efficiency spin-polarized electron sources

A. Walsh, X. Gong, W. Yin, 2009 .