Thom Dunning

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Kirk A PetersonProfessor of Chemistry, Washington State UniversityGeverifieerd e-mailadres voor wsu.edu
Robert J. HarrisonStony Brook UniversityGeverifieerd e-mailadres voor stonybrook.edu
Angela K. WilsonJohn A. Hannah Distinguished Professor of Chemistry, Michigan State UniversityGeverifieerd e-mailadres voor msu.edu
William A Goddard IIIProfessor Chemistry, Materials Science, Applied PhysicsGeverifieerd e-mailadres voor caltech.edu
Tanja van MourikReader, School of Chemistry, University of St AndrewsGeverifieerd e-mailadres voor st-andrews.ac.uk
Tyler Y. TakeshitaMercedes-Benz Research & Development North America, IncGeverifieerd e-mailadres voor illinois.edu
Lawrence HardingArgonne National LaboratoryGeverifieerd e-mailadres voor anl.gov
Aristides MavridisProfessor of Chemistry, Chemistry Department, National and Kapodistrian University of AthensGeverifieerd e-mailadres voor chem.uoa.gr
Apostolos KalemosDepartment of Chemistry, National and Kapodistrian University of AthensGeverifieerd e-mailadres voor chem.uoa.gr
Jeff LeidingLos Alamos National LaboratoryGeverifieerd e-mailadres voor lanl.gov
Donald TruhlarUniversity of MinnesotaGeverifieerd e-mailadres voor umn.edu
Joel BowmanProfessor of Chemistry, Emory UniversityGeverifieerd e-mailadres voor emory.edu
Henry F. Schaefer IIIProfessor of Chemistry, University of GeorgiaGeverifieerd e-mailadres voor uga.edu
James D MyersResearch Investigator, School of Information, University of MichiganGeverifieerd e-mailadres voor umich.edu
Shawn SendlingerProfessor of Chemistry, North Carolina Central UniversityGeverifieerd e-mailadres voor nccu.edu
Jeroen TrompBlair Professor of Geology and Professor of Applied and Computational Mathematics, PrincetonGeverifieerd e-mailadres voor princeton.edu
Klaus SchultenProfessor of Physics, University of Illinois at Urbana-ChampaignGeverifieerd e-mailadres voor ks.uiuc.edu

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Thom Dunning

Pacific Northwest National Laboratory & University of Washington

Geverifieerd e-mailadres voor uw.edu

Theoretical & Computational Chemistry


Titel Sorteren op citaties Sorteren op jaar Sorteren op titel	Geciteerd door Geciteerd door	Jaar
Gaussian basis sets for use in correlated molecular calculations. I. The atoms boron through neon and hydrogen TH Dunning Jr The Journal of chemical physics 90 (2), 1007-1023, 1989	33959	1989
Electron affinities of the first‐row atoms revisited. Systematic basis sets and wave functions RA Kendall, H Dunning, Jr., RJ Harrison Journal of Chemical Physics 96, 6796-6806, 1992	15911	1992
Gaussian basis sets for use in correlated molecular Calculations. Ill. The atoms aluminum through argon DE Woon, J Dunning, Thom H. J. Chem. Phys. 98 (2), 1358-1371, 1993	10936	1993
Gaussian Basis Sets for Molecular Calculations TH Dunning, Jr., PJ Hay Modern Theoretical Chemistry 3, 1-27, 1977	7083*	1977
Gaussian Basis Functions for Use in Molecular Calculations. I. Contraction of (9s5p) Atomic Basis Sets for the First Row Atoms TH Dunning, Jr. J. Chem. Phys. 53 (7), 2823-2833, 1970	5944	1970
Gaussian Basis Functions for Use in Molecular Calculations. I. Contraction of (9s5p) Atomic Basis Sets for the First Row Atoms TH Dunning, Jr. Chem. Phys 53 (7), 2823, 1970	5944	1970
Gaussian Basis Sets for Molecular Calculations TH Dunning, Jr., PJ Hay Methods of Electronic Structure Theory 3, 1-27, 1977	5754*	1977
Gaussian Basis Sets for Molecular Calculations TH Dunning, Jr., PJ Hay Methods of Electronic Structure Theory 3, 1-27, 1977	3306	1977
Gaussian basis sets for use in correlated molecular calculations. V. Core‐valence basis sets for boron through neon DE Woon, TH Dunning Jr The Journal of chemical physics 103 (11), 4572-4585, 1995	3247	1995
Gaussian basis sets for use in correlated molecular calculations. IV. Calculation of static electrical response properties DE Woon, TH Dunning Jr The Journal of chemical physics 100 (4), 2975-2988, 1994	2994	1994
Benchmark calculations with correlated molecular wave functions. IV. The classical barrier height of the H + H2→ H2 + H reaction KA Peterson, DE Woon, TH Dunning Jr The Journal of chemical physics 100 (10), 7410-7415, 1994	2047	1994
Accurate correlation consistent basis sets for molecular core–valence correlation effects: The second row atoms Al–Ar, and the first row atoms B–Ne revisited KA Peterson, TH Dunning Jr The Journal of chemical physics 117 (23), 10548-10560, 2002	1980	2002
Gaussian basis sets for use in correlated molecular calculations. X. The atoms aluminum through argon revisited TH Dunning Jr, KA Peterson, AK Wilson The Journal of Chemical Physics 114 (21), 9244-9253, 2001	1775	2001
Gaussian basis sets for use in correlated molecular calculations. IX. The atoms gallium through krypton AK Wilson, DE Woon, KA Peterson, TH Dunning The Journal of chemical physics 110 (16), 7667-7676, 1999	1600	1999
Gaussian basis sets for use in correlated molecular calculations. VI. Sextuple zeta correlation consistent basis sets for boron through neon AK Wilson, T Van Mourik, TH Dunning Jr Journal of Molecular Structure (Theochem) 388, 339-349, 1996	1426*	1996
Gaussian basis sets for use in correlated molecular calculations. VI. Sextuple zeta correlation consistent basis sets for boron through neon AK Wilson, T van Mourik, TH Dunning Jr Journal of Molecular Structure (Theochem) 388, 339-349, 1996	1228	1996
Ab initio studies of cyclic water clusters (H2O)n, n= 1–6. I. Optimal structures and vibrational spectra SS Xantheas, TH Dunning Jr The Journal of chemical physics 99 (11), 8774-8792, 1993	982	1993
The international exascale software project roadmap J Dongarra, P Beckman, T Moore, P Aerts, G Aloisio, JC Andre, D Barkai, ... The international journal of high performance computing applications 25 (1 …, 2011	949	2011
NWChem: Past, present, future E Apra, EJ Bylaska, WA de Jong, N Govind, K Kowalski, TP Straatsma, ... J. Chem. Phys. 152, 184102, 2020	839*	2020
Gaussian basis sets for use in correlated molecular calculations. VII. Valence, core-valence, and scalar relativistic basis sets for Li, Be, Na, and Mg BP Prascher, DE Woon, KA Peterson, TH Dunning, AK Wilson Theoretical Chemistry Accounts 128, 69-82, 2011	708	2011

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