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Alexander Mitrushchenkov

Showing results (1-10 of 6) with videos related to

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Journal of Chemical Theory and Computation|June 18, 2024
Optimizing Conical Intersections without Explicit Use of Non-Adiabatic CouplingsJuan Sanz García, Rosa Maskri, Alexander Mitrushchenkov, et al.
The Journal of Chemical Physics|October 21, 2011
Accurate ab initio ro-vibronic spectroscopy of the X̃2Π CCN radical using explicitly correlated methodsJ Grant Hill, Alexander Mitrushchenkov, Kazim E Yousaf, et al.
The Journal of Chemical Physics|July 9, 2021
Theoretical rovibronic spectroscopy of the calcium monohydroxide radical (CaOH)Alec Owens, Victoria H J Clark, Alexander Mitrushchenkov, et al.
Physical Chemistry Chemical Physics : PCCP|June 7, 2008
Local and density fitting approximations within the short-range/long-range hybrid scheme: application to large non-bonded complexesErich Goll, Thierry Leininger, Frederick R Manby, et al.
Inorganic Chemistry|May 1, 2014
Electronic structure of low-dimensional 4d(5) oxides: interplay of ligand distortions, overall lattice anisotropy, and spin-orbit interactionsVamshi M Katukuri, Karla Roszeitis, Viktor Yushankhai, et al.
The Journal of Chemical Physics|April 17, 2020
The Molpro quantum chemistry packageHans-Joachim Werner, Peter J Knowles, Frederick R Manby, et al.
Pageof 1

Showing results (1-10 of 6) with videos related to

Sort By:
Pageof 1
Journal of Chemical Theory and Computation|June 18, 2024
Optimizing Conical Intersections without Explicit Use of Non-Adiabatic CouplingsJuan Sanz García, Rosa Maskri, Alexander Mitrushchenkov, et al.
The Journal of Chemical Physics|October 21, 2011
Accurate ab initio ro-vibronic spectroscopy of the X̃2Π CCN radical using explicitly correlated methodsJ Grant Hill, Alexander Mitrushchenkov, Kazim E Yousaf, et al.
The Journal of Chemical Physics|July 9, 2021
Theoretical rovibronic spectroscopy of the calcium monohydroxide radical (CaOH)Alec Owens, Victoria H J Clark, Alexander Mitrushchenkov, et al.
Physical Chemistry Chemical Physics : PCCP|June 7, 2008
Local and density fitting approximations within the short-range/long-range hybrid scheme: application to large non-bonded complexesErich Goll, Thierry Leininger, Frederick R Manby, et al.
Inorganic Chemistry|May 1, 2014
Electronic structure of low-dimensional 4d(5) oxides: interplay of ligand distortions, overall lattice anisotropy, and spin-orbit interactionsVamshi M Katukuri, Karla Roszeitis, Viktor Yushankhai, et al.
The Journal of Chemical Physics|April 17, 2020
The Molpro quantum chemistry packageHans-Joachim Werner, Peter J Knowles, Frederick R Manby, et al.
Pageof 1