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Aleksandr V Marenich

Showing results (1-10 of 29) with videos related to

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The Journal of Physical Chemistry. A|May 2, 2007
Molecular spectroscopy beyond the born-oppenheimer approximation: a computational study of the CF(3)O and CF(3)S radicalsAleksandr V Marenich, James E Boggs
Journal of Chemical Theory and Computation|December 4, 2015
Ab Initio Study of Spin-Vibronic Dynamics in the Ground X̃(2)E and Excited Ã(2)A1 Electronic States of CH3S(•)Aleksandr V Marenich, James E Boggs
The Journal of Physical Chemistry. B|August 28, 2014
Electronic absorption spectra and solvatochromic shifts by the vertical excitation model: solvated clusters and molecular dynamics samplingAleksandr V Marenich, Christopher J Cramer, Donald G Truhlar
Journal of Chemical Theory and Computation|December 1, 2015
Universal Solvation Model Based on the Generalized Born Approximation with Asymmetric DescreeningAleksandr V Marenich, Christopher J Cramer, Donald G Truhlar
Journal of Chemical Theory and Computation|November 20, 2015
Uniform Treatment of Solute-Solvent Dispersion in the Ground and Excited Electronic States of the Solute Based on a Solvation Model with State-Specific PolarizabilityAleksandr V Marenich, Christopher J Cramer, Donald G Truhlar
The Journal of Physical Chemistry. B|April 16, 2009
Universal solvation model based on solute electron density and on a continuum model of the solvent defined by the bulk dielectric constant and atomic surface tensionsAleksandr V Marenich, Christopher J Cramer, Donald G Truhlar
The Journal of Physical Chemistry. B|March 4, 2009
Performance of SM6, SM8, and SMD on the SAMPL1 test set for the prediction of small-molecule solvation free energiesAleksandr V Marenich, Christopher J Cramer, Donald G Truhlar
Journal of Chemical Theory and Computation|November 22, 2015
Generalized Born Solvation Model SM12Aleksandr V Marenich, Christopher J Cramer, Donald G Truhlar
Journal of Chemical Theory and Computation|December 2, 2015
Perspective on Foundations of Solvation Modeling: The Electrostatic Contribution to the Free Energy of SolvationAleksandr V Marenich, Christopher J Cramer, Donald G Truhlar
Journal of Chemical Theory and Computation|December 1, 2015
Sorting Out the Relative Contributions of Electrostatic Polarization, Dispersion, and Hydrogen Bonding to Solvatochromic Shifts on Vertical Electronic Excitation EnergiesAleksandr V Marenich, Christopher J Cramer, Donald G Truhlar
Pageof 3

Showing results (1-10 of 29) with videos related to

Sort By:
Pageof 3
The Journal of Physical Chemistry. A|May 2, 2007
Molecular spectroscopy beyond the born-oppenheimer approximation: a computational study of the CF(3)O and CF(3)S radicalsAleksandr V Marenich, James E Boggs
Journal of Chemical Theory and Computation|December 4, 2015
Ab Initio Study of Spin-Vibronic Dynamics in the Ground X̃(2)E and Excited Ã(2)A1 Electronic States of CH3S(•)Aleksandr V Marenich, James E Boggs
The Journal of Physical Chemistry. B|August 28, 2014
Electronic absorption spectra and solvatochromic shifts by the vertical excitation model: solvated clusters and molecular dynamics samplingAleksandr V Marenich, Christopher J Cramer, Donald G Truhlar
Journal of Chemical Theory and Computation|December 1, 2015
Universal Solvation Model Based on the Generalized Born Approximation with Asymmetric DescreeningAleksandr V Marenich, Christopher J Cramer, Donald G Truhlar
Journal of Chemical Theory and Computation|November 20, 2015
Uniform Treatment of Solute-Solvent Dispersion in the Ground and Excited Electronic States of the Solute Based on a Solvation Model with State-Specific PolarizabilityAleksandr V Marenich, Christopher J Cramer, Donald G Truhlar
The Journal of Physical Chemistry. B|April 16, 2009
Universal solvation model based on solute electron density and on a continuum model of the solvent defined by the bulk dielectric constant and atomic surface tensionsAleksandr V Marenich, Christopher J Cramer, Donald G Truhlar
The Journal of Physical Chemistry. B|March 4, 2009
Performance of SM6, SM8, and SMD on the SAMPL1 test set for the prediction of small-molecule solvation free energiesAleksandr V Marenich, Christopher J Cramer, Donald G Truhlar
Journal of Chemical Theory and Computation|November 22, 2015
Generalized Born Solvation Model SM12Aleksandr V Marenich, Christopher J Cramer, Donald G Truhlar
Journal of Chemical Theory and Computation|December 2, 2015
Perspective on Foundations of Solvation Modeling: The Electrostatic Contribution to the Free Energy of SolvationAleksandr V Marenich, Christopher J Cramer, Donald G Truhlar
Journal of Chemical Theory and Computation|December 1, 2015
Sorting Out the Relative Contributions of Electrostatic Polarization, Dispersion, and Hydrogen Bonding to Solvatochromic Shifts on Vertical Electronic Excitation EnergiesAleksandr V Marenich, Christopher J Cramer, Donald G Truhlar
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