Weitao Yang

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Paula Mori-SanchezUniversidad Autónoma de MadridEmail verificata su uam.es
Aron CohenMax Planck Institute for Solid State ResearchEmail verificata su fkf.mpg.de
Harold U BarangerDuke UniversityEmail verificata su phy.duke.edu
David N. BeratanR.J. Reynolds Professor, Department of Chemistry, Duke UniversityEmail verificata su duke.edu
Julia Contreras-GarcíaCNRS & Sorbonne UniversitéEmail verificata su lct.jussieu.fr
Shahar KeinanCEO, Polaris Quantum BiotechEmail verificata su polarisqb.com
Erin R JohnsonHerzberg-Becke Chair in Theoretical Chemistry, Dalhousie UniversityEmail verificata su dal.ca
Lee BartolottiProfessor of Chemistry, East Carolina UniversityEmail verificata su ecu.edu
Yingkai ZhangProfessor of Chemistry, New York UniversityEmail verificata su nyu.edu
Darrin M. YorkHenry Rutgers University Professor, Rutgers UniversityEmail verificata su rutgers.edu
Taisung LeeRutgers UniversityEmail verificata su rutgers.edu
Neil Qiang Su (苏乃强)Nankai UniversityEmail verificata su nankai.edu.cn
Qin WuChemist, Center for Functional Nanomaterials, Brookhaven National LaboratoryEmail verificata su bnl.gov
Du ZhangTokyo Electron LimitedEmail verificata su us.tel.com
Yang YangAssistant Professor at UW-MadisonEmail verificata su wisc.edu
Paul W. AyersProfessor of Chemistry & Chemical Biology, McMaster UniversityEmail verificata su chemistry.mcmaster.ca
Piotr E MarszalekDuke UniversityEmail verificata su duke.edu
Robin ChaudretSchrödingerEmail verificata su schrodinger.com
Xiao ZhengFudan UniversityEmail verificata su ustc.edu.cn
Xiancheng ZengPostdoctoral Fellow, University of MichiganEmail verificata su umich.edu

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Weitao Yang

Philip Handler Professor, Department of Chemistry, Duke University

Email verificata su duke.edu - Home page

theoretical chemistry density functional theory computational chemistry biophysics physical chemistry


Titolo Ordina per citazioni Ordina per anno Ordina per titolo	Citata da Citata da	Anno
Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density C Lee, W Yang, RG Parr Physical review B 37 (2), 785, 1988	110270	1988
Density Functional Theory of Atoms and Molecules RG Parr, W Yang	27616*
Revealing noncovalent interactions ER Johnson, S Keinan, P Mori-Sánchez, J Contreras-García, AJ Cohen, ... Journal of the American Chemical Society 132 (18), 6498-6506, 2010	7752	2010
Density functional approach to the frontier-electron theory of chemical reactivity RG Parr, W Yang Journal of the American Chemical Society 106 (14), 4049-4050, 1984	3801	1984
NCIPLOT: a program for plotting noncovalent interaction regions J Contreras-García, ER Johnson, S Keinan, R Chaudret, JP Piquemal, ... Journal of chemical theory and computation 7 (3), 625-632, 2011	3501	2011
Comment on “Generalized gradient approximation made simple” Y Zhang, W Yang Physical Review Letters 80 (4), 890, 1998	3334	1998
Insights into current limitations of density functional theory AJ Cohen, P Mori-Sánchez, W Yang Science 321 (5890), 792-794, 2008	2843	2008
Challenges for density functional theory AJ Cohen, P Mori-Sánchez, W Yang Chemical reviews 112 (1), 289-320, 2012	2772	2012
The use of global and local molecular parameters for the analysis of the gas-phase basicity of amines W Yang, WJ Mortier Journal of the American Chemical Society 108 (19), 5708-5711, 1986	2082	1986
Hardness, softness, and the fukui function in the electronic theory of metals and catalysis W Yang, RG Parr Proceedings of the National Academy of Sciences 82 (20), 6723-6726, 1985	2030	1985
Localization and delocalization errors in density functional theory and implications for band-gap prediction P Mori-Sánchez, AJ Cohen, W Yang Physical review letters 100 (14), 146401, 2008	1383	2008
Density-functional theory of the electronic structure of molecules RG Parr, W Yang Annual Review of Physical Chemistry 46 (1), 701-728, 1995	1238	1995
Direct calculation of electron density in density-functional theory W Yang Physical Review Letters 66 (11), 1438, 1991	1225	1991
Custom Search 2 DM York, TS Lee, GM Giambasu, A Moser, K Nam, C Silva-Lopez, ... ACS Symposium Series 712, 275-287, 1998	1182*	1998
Empirical correction to density functional theory for van der Waals interactions Q Wu, W Yang The Journal of chemical physics 116 (2), 515-524, 2002	1025	2002
Many-electron self-interaction error in approximate density functionals P Mori-Sánchez, AJ Cohen, W Yang The Journal of chemical physics 125 (20), 201102, 2006	859	2006
All The Catalytic Active Sites of MoS₂ for Hydrogen Evolution G Li, D Zhang, Q Qiao, Y Yu, D Peterson, A Zafar, R Kumar, S Curtarolo, ... Journal of the American Chemical Society 138 (51), 16632-16638, 2016	799	2016
Layer-Dependent Electrocatalysis of MoS2 for Hydrogen Evolution Y Yu, SY Huang, Y Li, SN Steinmann, W Yang, L Cao Nano letters 14 (2), 553-558, 2014	791	2014
A challenge for density functionals: Self-interaction error increases for systems with a noninteger number of electrons Y Zhang, W Yang The Journal of chemical physics 109 (7), 2604-2608, 1998	684	1998
Fractional charge perspective on the band gap in density-functional theory AJ Cohen, P Mori-Sánchez, W Yang Physical Review B 77 (11), 115123, 2008	682	2008

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