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Radovan Bast

Showing results (11-20 of 36) with videos related to

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Physical Chemistry Chemical Physics : PCCP|November 15, 2011
4-Component relativistic magnetically induced current density using London atomic orbitalsDavid Sulzer, Małgorzata Olejniczak, Radovan Bast, et al.
The Journal of Physical Chemistry. A|November 21, 2014
Four-component relativistic calculations in solution with the polarizable continuum model of solvation: theory, implementation, and application to the group 16 dihydrides H2X (X = O, S, Se, Te, Po)Roberto Di Remigio, Radovan Bast, Luca Frediani, et al.
The Journal of Chemical Physics|March 3, 2007
Methodological aspects in the calculation of parity-violating effects in nuclear magnetic resonance parametersVille Weijo, Radovan Bast, Pekka Manninen, et al.
The Journal of Chemical Physics|October 10, 2014
Analytic calculations of hyper-Raman spectra from density functional theory hyperpolarizability gradientsMagnus Ringholm, Radovan Bast, Luca Oggioni, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry|January 29, 2008
Static and frequency-dependent dipole-dipole polarizabilities of all closed-shell atoms up to radium: a four-component relativistic DFT studyRadovan Bast, Andreas Hesselmann, Paweł Sałek, et al.
Journal of Chemical Theory and Computation|December 1, 2015
Arbitrary-Order Density Functional Response Theory from Automatic DifferentiationUlf Ekström, Lucas Visscher, Radovan Bast, et al.
The Journal of Physical Chemistry. A|January 11, 2014
Analytic density functional theory calculations of pure vibrational hyperpolarizabilities: the first dipole hyperpolarizability of retinal and related moleculesBin Gao, Magnus Ringholm, Radovan Bast, et al.
Physical Chemistry Chemical Physics : PCCP|December 25, 2010
The ab initio calculation of molecular electric, magnetic and geometric propertiesRadovan Bast, Ulf Ekström, Bin Gao, et al.
The Journal of Physical Chemistry. A|February 19, 2021
Spatial Contributions to Nuclear Magnetic ShieldingsRahul Kumar Jinger, Heike Fliegl, Radovan Bast, et al.
The Journal of Physical Chemistry. A|June 25, 2011
The first and second static electronic hyperpolarizabilities of zigzag boron nitride nanotubes. An ab initio approach through the coupled perturbed Kohn-Sham schemeRoberto Orlando, Radovan Bast, Kenneth Ruud, et al.
Pageof 4

Showing results (11-20 of 36) with videos related to

Sort By:
Pageof 4
Physical Chemistry Chemical Physics : PCCP|November 15, 2011
4-Component relativistic magnetically induced current density using London atomic orbitalsDavid Sulzer, Małgorzata Olejniczak, Radovan Bast, et al.
The Journal of Physical Chemistry. A|November 21, 2014
Four-component relativistic calculations in solution with the polarizable continuum model of solvation: theory, implementation, and application to the group 16 dihydrides H2X (X = O, S, Se, Te, Po)Roberto Di Remigio, Radovan Bast, Luca Frediani, et al.
The Journal of Chemical Physics|March 3, 2007
Methodological aspects in the calculation of parity-violating effects in nuclear magnetic resonance parametersVille Weijo, Radovan Bast, Pekka Manninen, et al.
The Journal of Chemical Physics|October 10, 2014
Analytic calculations of hyper-Raman spectra from density functional theory hyperpolarizability gradientsMagnus Ringholm, Radovan Bast, Luca Oggioni, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry|January 29, 2008
Static and frequency-dependent dipole-dipole polarizabilities of all closed-shell atoms up to radium: a four-component relativistic DFT studyRadovan Bast, Andreas Hesselmann, Paweł Sałek, et al.
Journal of Chemical Theory and Computation|December 1, 2015
Arbitrary-Order Density Functional Response Theory from Automatic DifferentiationUlf Ekström, Lucas Visscher, Radovan Bast, et al.
The Journal of Physical Chemistry. A|January 11, 2014
Analytic density functional theory calculations of pure vibrational hyperpolarizabilities: the first dipole hyperpolarizability of retinal and related moleculesBin Gao, Magnus Ringholm, Radovan Bast, et al.
Physical Chemistry Chemical Physics : PCCP|December 25, 2010
The ab initio calculation of molecular electric, magnetic and geometric propertiesRadovan Bast, Ulf Ekström, Bin Gao, et al.
The Journal of Physical Chemistry. A|February 19, 2021
Spatial Contributions to Nuclear Magnetic ShieldingsRahul Kumar Jinger, Heike Fliegl, Radovan Bast, et al.
The Journal of Physical Chemistry. A|June 25, 2011
The first and second static electronic hyperpolarizabilities of zigzag boron nitride nanotubes. An ab initio approach through the coupled perturbed Kohn-Sham schemeRoberto Orlando, Radovan Bast, Kenneth Ruud, et al.
Pageof 4