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David B Krisiloff

Showing results (1-10 of 8) with videos related to

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Physical Chemistry Chemical Physics : PCCP|February 24, 2012
Approximately size extensive local Multireference Singles and Doubles Configuration InteractionDavid B Krisiloff, Emily A Carter
The Journal of Physical Chemistry. A|February 20, 2015
Correction to "Ab initio reaction kinetics of hydrogen abstraction from methyl formate by hydrogen, methyl, oxygen, hydroxyl, and hydroperoxy radicals"Ting Tan, Michele Pavone, David B Krisiloff, et al.
The Journal of Physical Chemistry. A|July 27, 2012
Ab initio reaction kinetics of hydrogen abstraction from methyl formate by hydrogen, methyl, oxygen, hydroxyl, and hydroperoxy radicalsTing Tan, Michele Pavone, David B Krisiloff, et al.
The Journal of Chemical Physics|January 21, 2014
Analysis of and remedies for unphysical ground states of the multireference averaged coupled-pair functionalDavid B Krisiloff, Victor B Oyeyemi, Florian Libisch, et al.
Journal of Chemical Theory and Computation|November 18, 2015
Density Fitting and Cholesky Decomposition of the Two-Electron Integrals in Local Multireference Configuration Interaction TheoryDavid B Krisiloff, Caroline M Krauter, Francis J Ricci, et al.
The Journal of Physical Chemistry. A|March 17, 2015
Bond dissociation energies of C10 and C18 methyl esters from local multireference averaged-coupled pair functional theoryVictor B Oyeyemi, Johannes M Dieterich, David B Krisiloff, et al.
Journal of Chemical Theory and Computation|April 26, 2017
Local Electron Correlation Treatment in Extended Multireference Calculations: Effect of Acceptor-Donor Substituents on the Biradical Character of the Polycyclic Aromatic Hydrocarbon HeptazethreneAnita Das, Thomas Müller, Felix Plasser, et al.
The Journal of Chemical Physics|February 12, 2015
Size-extensivity-corrected multireference configuration interaction schemes to accurately predict bond dissociation energies of oxygenated hydrocarbonsVictor B Oyeyemi, David B Krisiloff, John A Keith, et al.
Pageof 1

Showing results (1-10 of 8) with videos related to

Sort By:
Pageof 1
Physical Chemistry Chemical Physics : PCCP|February 24, 2012
Approximately size extensive local Multireference Singles and Doubles Configuration InteractionDavid B Krisiloff, Emily A Carter
The Journal of Physical Chemistry. A|February 20, 2015
Correction to "Ab initio reaction kinetics of hydrogen abstraction from methyl formate by hydrogen, methyl, oxygen, hydroxyl, and hydroperoxy radicals"Ting Tan, Michele Pavone, David B Krisiloff, et al.
The Journal of Physical Chemistry. A|July 27, 2012
Ab initio reaction kinetics of hydrogen abstraction from methyl formate by hydrogen, methyl, oxygen, hydroxyl, and hydroperoxy radicalsTing Tan, Michele Pavone, David B Krisiloff, et al.
The Journal of Chemical Physics|January 21, 2014
Analysis of and remedies for unphysical ground states of the multireference averaged coupled-pair functionalDavid B Krisiloff, Victor B Oyeyemi, Florian Libisch, et al.
Journal of Chemical Theory and Computation|November 18, 2015
Density Fitting and Cholesky Decomposition of the Two-Electron Integrals in Local Multireference Configuration Interaction TheoryDavid B Krisiloff, Caroline M Krauter, Francis J Ricci, et al.
The Journal of Physical Chemistry. A|March 17, 2015
Bond dissociation energies of C10 and C18 methyl esters from local multireference averaged-coupled pair functional theoryVictor B Oyeyemi, Johannes M Dieterich, David B Krisiloff, et al.
Journal of Chemical Theory and Computation|April 26, 2017
Local Electron Correlation Treatment in Extended Multireference Calculations: Effect of Acceptor-Donor Substituents on the Biradical Character of the Polycyclic Aromatic Hydrocarbon HeptazethreneAnita Das, Thomas Müller, Felix Plasser, et al.
The Journal of Chemical Physics|February 12, 2015
Size-extensivity-corrected multireference configuration interaction schemes to accurately predict bond dissociation energies of oxygenated hydrocarbonsVictor B Oyeyemi, David B Krisiloff, John A Keith, et al.
Pageof 1