Search research articles
Contact Us
Filters
Showing results (11-20 of 28) with videos related to
Page
of 3
Sort By:
Physical Chemistry Chemical Physics : PCCP
|
June 10, 2006
How accurate is the CASPT2 method?
Zahra Azizi, Björn O Roos, Valera Veryazov
Journal of Chemical Theory and Computation
|
November 19, 2019
The ANO-R Basis Set
J Patrick Zobel, Per-Olof Widmark, Valera Veryazov
Journal of Chemical Theory and Computation
|
April 20, 2021
Correction to "The ANO-R Basis Set"
J Patrick Zobel, Per-Olof Widmark, Valera Veryazov
The Journal of Physical Chemistry. A
|
August 13, 2008
A combined theoretical and experimental study of simple terminal group 6 nitride and phosphide N[triple bond]MX3 and P[triple bond]MX3 molecules
Xuefeng Wang, Lester Andrews, Roland Lindh, et al.
Inorganic Chemistry
|
November 14, 2008
Bond length and bond order in one of the shortest Cr-Cr bonds
Giovanni La Macchia, Francesco Aquilante, Valera Veryazov, et al.
Dalton Transactions (Cambridge, England : 2003)
|
January 11, 2020
Is density functional theory accurate for lytic polysaccharide monooxygenase enzymes?
Ernst D Larsson, Geng Dong, Valera Veryazov, et al.
The Journal of Physical Chemistry. B
|
October 28, 2008
Not innocent: verdict from ab initio multiconfigurational second-order perturbation theory on the electronic structure of chloroiron corrole
Björn O Roos, Valera Veryazov, Jeanet Conradie, et al.
The Journal of Physical Chemistry. A
|
July 13, 2006
New relativistic ANO basis sets for transition metal atoms
Björn O Roos, Roland Lindh, Per-Ake Malmqvist, et al.
The Journal of Chemical Physics
|
November 24, 2018
New compact density matrix averaged ANO basis sets for relativistic calculations
Per-Olof Widmark, J Patrick Zobel, Victor P Vysotskiy, et al.
Journal of Computational Chemistry
|
June 11, 2013
Parallelization of a multiconfigurational perturbation theory
Steven Vancoillie, Mickaël G Delcey, Roland Lindh, et al.
Page
of 3
Search research articles
Search
Showing results (11-20 of 28) with videos related to
Sort By:
Page
of 3
Physical Chemistry Chemical Physics : PCCP
|
June 10, 2006
How accurate is the CASPT2 method?
Zahra Azizi, Björn O Roos, Valera Veryazov
Journal of Chemical Theory and Computation
|
November 19, 2019
The ANO-R Basis Set
J Patrick Zobel, Per-Olof Widmark, Valera Veryazov
Journal of Chemical Theory and Computation
|
April 20, 2021
Correction to "The ANO-R Basis Set"
J Patrick Zobel, Per-Olof Widmark, Valera Veryazov
The Journal of Physical Chemistry. A
|
August 13, 2008
A combined theoretical and experimental study of simple terminal group 6 nitride and phosphide N[triple bond]MX3 and P[triple bond]MX3 molecules
Xuefeng Wang, Lester Andrews, Roland Lindh, et al.
Inorganic Chemistry
|
November 14, 2008
Bond length and bond order in one of the shortest Cr-Cr bonds
Giovanni La Macchia, Francesco Aquilante, Valera Veryazov, et al.
Dalton Transactions (Cambridge, England : 2003)
|
January 11, 2020
Is density functional theory accurate for lytic polysaccharide monooxygenase enzymes?
Ernst D Larsson, Geng Dong, Valera Veryazov, et al.
The Journal of Physical Chemistry. B
|
October 28, 2008
Not innocent: verdict from ab initio multiconfigurational second-order perturbation theory on the electronic structure of chloroiron corrole
Björn O Roos, Valera Veryazov, Jeanet Conradie, et al.
The Journal of Physical Chemistry. A
|
July 13, 2006
New relativistic ANO basis sets for transition metal atoms
Björn O Roos, Roland Lindh, Per-Ake Malmqvist, et al.
The Journal of Chemical Physics
|
November 24, 2018
New compact density matrix averaged ANO basis sets for relativistic calculations
Per-Olof Widmark, J Patrick Zobel, Victor P Vysotskiy, et al.
Journal of Computational Chemistry
|
June 11, 2013
Parallelization of a multiconfigurational perturbation theory
Steven Vancoillie, Mickaël G Delcey, Roland Lindh, et al.
Page
of 3