Search research articles
Contact Us
Filters
Showing results (11-20 of 19) with videos related to
Page
of 2
Sort By:
You have reached the last page of results.
This site can display upto 19 results.
The Journal of Chemical Physics
|
January 23, 2026
A perturbative triples correction scheme to relativistic quadratic unitary coupled cluster method: Theory, implementation and benchmarking
Kamal Majee, Ján Šimunek, Jozef Noga, et al.
The Journal of Chemical Physics
|
August 24, 2010
Anharmonic vibrational analysis of water with traditional and explicitly correlated coupled cluster methods
Kalju Kahn, Bernard Kirtman, Jozef Noga, et al.
The Journal of Chemical Physics
|
May 10, 2008
Explicitly correlated coupled cluster F12 theory with single and double excitations
Jozef Noga, Stanislav Kedzuch, Ján Simunek, et al.
Journal of Computational Chemistry
|
July 28, 2011
Acceleration of self-consistent-field convergence by combining conventional diagonalization and a diagonalization-free procedure
Alexander Baldes, Wim Klopper, Ján Simunek, et al.
The Journal of Chemical Physics
|
November 1, 2022
The four-component DFT method for the calculation of the EPR g-tensor using a restricted magnetically balanced basis and London atomic orbitals
Debora Misenkova, Florian Lemken, Michal Repisky, et al.
Physical Chemistry Chemical Physics : PCCP
|
March 2, 2012
An explicitly correlated Mukherjee's state specific coupled cluster method: development and pilot applications
Ondřej Demel, Stanislav Kedžuch, Matej Švaňa, et al.
Journal of Computational Chemistry
|
July 5, 2014
Implementation of the diagonalization-free algorithm in the self-consistent field procedure within the four-component relativistic scheme
Marcela Hrdá, Tomáš Kulich, Michal Repiský, et al.
The Journal of Chemical Physics
|
December 3, 2008
R12-calibrated H2O-H2 interaction: full dimensional and vibrationally averaged potential energy surfaces
Pierre Valiron, Michael Wernli, Alexandre Faure, et al.
Chemical Science
|
March 14, 2022
A free boratriptycene-type Lewis superacid
Marcel Henkelmann, Andreas Omlor, Michael Bolte, et al.
Page
of 2
Search research articles
Search
Showing results (11-20 of 19) with videos related to
Sort By:
Page
of 2
You have reached the last page of results.
This site can display upto 19 results.
The Journal of Chemical Physics
|
January 23, 2026
A perturbative triples correction scheme to relativistic quadratic unitary coupled cluster method: Theory, implementation and benchmarking
Kamal Majee, Ján Šimunek, Jozef Noga, et al.
The Journal of Chemical Physics
|
August 24, 2010
Anharmonic vibrational analysis of water with traditional and explicitly correlated coupled cluster methods
Kalju Kahn, Bernard Kirtman, Jozef Noga, et al.
The Journal of Chemical Physics
|
May 10, 2008
Explicitly correlated coupled cluster F12 theory with single and double excitations
Jozef Noga, Stanislav Kedzuch, Ján Simunek, et al.
Journal of Computational Chemistry
|
July 28, 2011
Acceleration of self-consistent-field convergence by combining conventional diagonalization and a diagonalization-free procedure
Alexander Baldes, Wim Klopper, Ján Simunek, et al.
The Journal of Chemical Physics
|
November 1, 2022
The four-component DFT method for the calculation of the EPR g-tensor using a restricted magnetically balanced basis and London atomic orbitals
Debora Misenkova, Florian Lemken, Michal Repisky, et al.
Physical Chemistry Chemical Physics : PCCP
|
March 2, 2012
An explicitly correlated Mukherjee's state specific coupled cluster method: development and pilot applications
Ondřej Demel, Stanislav Kedžuch, Matej Švaňa, et al.
Journal of Computational Chemistry
|
July 5, 2014
Implementation of the diagonalization-free algorithm in the self-consistent field procedure within the four-component relativistic scheme
Marcela Hrdá, Tomáš Kulich, Michal Repiský, et al.
The Journal of Chemical Physics
|
December 3, 2008
R12-calibrated H2O-H2 interaction: full dimensional and vibrationally averaged potential energy surfaces
Pierre Valiron, Michael Wernli, Alexandre Faure, et al.
Chemical Science
|
March 14, 2022
A free boratriptycene-type Lewis superacid
Marcel Henkelmann, Andreas Omlor, Michael Bolte, et al.
Page
of 2