Weiwei Gao

发表

Chlorine adsorption on Au(111): chlorine overlayer or surface chloride?

E. Kaxiras, Ling Zhou, C. Friend, 2008, Journal of the American Chemical Society.

One-step pyrolytic synthesis of nitrogen and sulfur dual-doped porous carbon with high catalytic activity and good accessibility to small biomolecules.

Wenbo Song, Weiwei Gao, Hao Huang, 2014, ACS applied materials & interfaces.

Discrimination and simultaneous determination of hydroquinone and catechol by tunable polymerization of imidazolium-based ionic liquid on multi-walled carbon nanotube surfaces.

Hongyan Shi, Wenbo Song, Shenghai Zhou, 2013, Analytica chimica acta.

Nitrogen-rich graphene from small molecules as high performance anode material

Hongyan Shi, Wenbo Song, Weiwei Gao, 2014, Nanotechnology.

Manganese dioxide modified silicon nanowires and their excellent catalysis in the decomposition of methylene blue

Mingwang Shao, Shuitong Lee, Shujuan Zhuo, 2012 .

Solution-combusting preparation of mono-dispersed Mn3O4 nanoparticles for electrochemical applications

Mingwang Shao, Weiwei Gao, Shiyong Ye, 2011 .

Formation of nanoscale composites of compound semiconductors driven by charge transfer

M. Toney, K. Yu, W. Walukiewicz, 2016, 2016 Compound Semiconductor Week (CSW) [Includes 28th International Conference on Indium Phosphide & Related Materials (IPRM) & 43rd International Symposium on Compound Semiconductors (ISCS).

Strong Dzyaloshinskii-Moriya interaction in monolayer CrI3 on metal substrates

Jijun Zhao, Yabei Wu, Fan Zhang, 2022, Physical Review B.

Out-of-plane polarization and topological magnetic vortices in multiferroic CrPSe$_3$

J. Chelikowsky, Jijun Zhao, Weiwei Gao, 2022, 2209.08442.

MoSi2N4: An emerging 2D electronic material with protected band edge states and dielectric tunable quasiparticle and optical properties

Peihong Zhang, Wenguang Zhu, Yabei Wu, 2021 .

Quasiparticle band gap of organic-inorganic hybrid perovskites: Crystal structure, spin-orbit coupling, and self-energy effects

Shengbai Zhang, Peihong Zhang, Yi-Yang Sun, 2016 .

Sumanene Monolayer of Pure Carbon: A Two-Dimensional Kagome-Analogy Lattice with Desirable Band Gap, Ultrahigh Carrier Mobility, and Strong Exciton Binding Energy.

Jijun Zhao, Yong-Wei Zhang, Hongsheng Liu, 2022, Small.

Giant excitonic effects in vacancy-ordered double perovskites

Peihong Zhang, Fan Zhang, Weiwei Gao, 2022, Physical Review B.

Stabilization of surface reaction intermediates by added metal atoms on metal surfaces of low free energy.

Ling Zhou, R. Madix, A. Klust, 2008, The Journal of chemical physics.

Prediction of Intrinsic Ferroelectricity and Large Piezoelectricity in Monolayer Arsenic Chalcogenides.

J. Chelikowsky, Weiwei Gao, 2020, Nano letters.

Interaction of chlorine with Au-O surface complexes

Ling Zhou, C. Friend, Weiwei Gao, 2007 .

Quasiparticle band structures of CuCl, CuBr, AgCl, and AgBr: The extreme case

Peihong Zhang, W. Ren, Yabei Wu, 2018, Physical Review B.

Speeding up GW Calculations to Meet the Challenge of Large Scale Quasiparticle Predictions

Peihong Zhang, Weiyi Xia, Xiang Gao, 2016, Scientific Reports.

A real-space based benchmark of G0W0 calculations on GW100: effects of semi-core orbitals and orbital reordering.

J. Chelikowsky, Weiwei Gao, 2019, Journal of chemical theory and computation.

Combined subsampling and analytical integration for efficient large-scale GW calculations for 2D systems

Peihong Zhang, W. Ren, Yabei Wu, 2020, npj Computational Materials.

Quasiparticle electronic structure of honeycomb C3N: from monolayer to bulk

Peihong Zhang, W. Ren, Yabei Wu, 2018, 2D Materials.

Discovering lead-free perovskite solar materials with a split-anion approach.

Jian Shi, Shengbai Zhang, Peihong Zhang, 2016, Nanoscale.

Chlorine promotion of styrene epoxidation on Au(111).

Ling Zhou, C. Friend, Weiwei Gao, 2007, Journal of the American Chemical Society.

Accelerating time-dependent density functional theory and GW calculations for molecules and nanoclusters with symmetry adapted interpolative separable density fitting.

J. Chelikowsky, Weiwei Gao, 2020, Journal of chemical theory and computation.

Pressure-induced structural transition of CdxZn1−xO alloys

R. Jeanloz, Joonki Suh, Junqiao Wu, 2016 .

Engineering the Near-Edge Electronic Structure of SnSe through Strains

Peihong Zhang, W. Ren, Yabei Wu, 2017 .

Theory of oxygen-boron vacancy defect in cubic boron nitride: a diamond NV⁻ isoelectronic center.

S. Zhang, Peihong Zhang, Y. Sun, 2014, Physical review letters.

Prediction of protected band edge states and dielectric tunable quasiparticle and excitonic properties of monolayer MoSi2N4

Peihong Zhang, Wenguang Zhu, Yabei Wu, 2021, npj Computational Materials.

Near-edge band structures and band gaps of Cu-based semiconductors predicted by the modified Becke-Johnson potential plus an on-site Coulomb U.

Peihong Zhang, Yubo Zhang, Wenqing Zhang, 2013, The Journal of chemical physics.

Defect tolerance in chalcogenide perovskite photovoltaic material BaZrS3

H. Zeng, Shengbai Zhang, Peihong Zhang, 2021, Science China Materials.

On the applicability of hybrid functionals for predicting fundamental properties of metals

Shengbai Zhang, Peihong Zhang, Tianyi Cai, 2016 .

Studies of the electronic structure at the Fe3O4-NiO interface

V. Henrich, E. Altman, Weiwei Gao, 2004 .

Numerical methods for efficient GW calculations and the applications in low-dimensional systems

Peihong Zhang, Weiyi Xia, Weiwei Gao, 2022, Electronic Structure.

The stability, electronic structure, and optical absorption of boron-nitride diamondoids predicted with first-principles calculations.

J. Chelikowsky, S. Ogut, Weiwei Gao, 2018, Physical chemistry chemical physics : PCCP.

Rich structural polymorphism of monolayer C60 from cluster rotation

Weiwei Gao, Jijun Zhao, Xuefei Wang, 2023, 2305.03339.

Growth and structure of vanadium oxide on anatase (101) terraces

E. Altman, Weiwei Gao, 2006 .

Growth and surface structure of vanadium oxide on anatase (0 0 1)

Victor E. Henrich, Weiwei Gao, Chong-Min Wang, 2004 .

Optically Driven Magnetic Phase Transition of Monolayer RuCl3.

J. Chelikowsky, Li Yang, E. Henriksen, 2019, Nano letters.

Towards Fully Converged GW Calculations for Large Systems

Peihong Zhang, Weiyi Xia, Xiang Gao, 2016, 1601.06767.