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Viktor N. Staroverov
Viktor N. Staroverov
Professor, Department of Chemistry, The University of Western Ontario
Zweryfikowany adres z uwo.ca - Strona główna
Tytuł
Cytowane przez
Cytowane przez
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Gaussian 16
MJ Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ...
Gaussian Inc.: Wallingford, CT, USA, 2016
29188*2016
Climbing the density functional ladder: Nonempirical meta–generalized gradient approximation designed for molecules and solids
J Tao, JP Perdew, VN Staroverov, GE Scuseria
Physical Review Letters 91 (14), 146401, 2003
79612003
Gaussian 09
MJ Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ...
Gaussian Inc.: Wallingford, CT, USA, 2009
4364*2009
Comparative assessment of a new nonempirical density functional: Molecules and hydrogen-bonded complexes
VN Staroverov, GE Scuseria, J Tao, JP Perdew
The Journal of Chemical Physics 119 (23), 12129-12137, 2003
29652003
Prescription for the design and selection of density functional approximations: More constraint satisfaction with fewer fits
JP Perdew, A Ruzsinszky, J Tao, VN Staroverov, GE Scuseria, GI Csonka
The Journal of Chemical Physics 123 (6), 062201, 2005
13022005
Meta-generalized gradient approximation: Explanation of a realistic nonempirical density functional
JP Perdew, J Tao, VN Staroverov, GE Scuseria
The Journal of Chemical Physics 120 (15), 6898-6911, 2004
6232004
Tests of a ladder of density functionals for bulk solids and surfaces
VN Staroverov, GE Scuseria, J Tao, JP Perdew
Physical Review B 69 (7), 075102, 2004
5472004
Density functional with full exact exchange, balanced nonlocality of correlation, and constraint satisfaction
JP Perdew, VN Staroverov, J Tao, GE Scuseria
Physical Review A 78 (5), 052513, 2008
2992008
Distribution of effectively unpaired electrons
VN Staroverov, ER Davidson
Chemical Physics Letters 330 (1-2), 161-168, 2000
2782000
Is the hydrogen bond in water dimer and ice covalent?
TK Ghanty, VN Staroverov, PR Koren, ER Davidson
Journal of the American Chemical Society 122 (6), 1210-1214, 2000
2242000
Optimized effective potentials yielding Hartree–Fock energies and densities
VN Staroverov, GE Scuseria, ER Davidson
The Journal of Chemical Physics 124 (14), 141103, 2006
2182006
DFT exchange: sharing perspectives on the workhorse of quantum chemistry and materials science
AM Teale, T Helgaker, A Savin, C Adamo, B Aradi, AV Arbuznikov, ...
Physical Chemistry Chemical Physics 24 (47), 28700-28781, 2022
1852022
A germanium (II)-centered dication
PA Rupar, VN Staroverov, PJ Ragogna, KM Baines
Journal of the American Chemical Society 129 (49), 15138-15139, 2007
1752007
Exchange and correlation in open systems of fluctuating electron number
JP Perdew, A Ruzsinszky, GI Csonka, OA Vydrov, GE Scuseria, ...
Physical Review A 76 (4), 040501, 2007
1662007
A cryptand-encapsulated germanium (II) dication
PA Rupar, VN Staroverov, KM Baines
Science 322 (5906), 1360-1363, 2008
1622008
Diradical character of the cope rearrangement transition state
VN Staroverov, ER Davidson
Journal of the American Chemical Society 122 (1), 186-187, 2000
1562000
Progress in the development of exchange-correlation functionals
GE Scuseria, VN Staroverov
Theory and Applications of Computational Chemistry, ed. by CE Dykstra, G …, 2005
1482005
Exact-exchange energy density in the gauge of a semilocal density-functional approximation
J Tao, VN Staroverov, GE Scuseria, JP Perdew
Physical Review A 77 (1), 012509, 2008
1352008
Effect of extended π conjugation on the spectroscopic and electrochemical properties of boron difluoride formazanate complexes
SM Barbon, VN Staroverov, JB Gilroy
The Journal of Organic Chemistry 80 (10), 5226-5235, 2015
1092015
Effective local potentials for orbital-dependent density functionals
VN Staroverov, GE Scuseria, ER Davidson
The Journal of Chemical Physics 125 (8), 081104, 2006
1052006
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