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Stefan Grimme

Showing results (1-10 of 552) with videos related to

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Angewandte Chemie (International Ed. in English)|May 1, 2013
Towards first principles calculation of electron impact mass spectra of moleculesStefan Grimme
The Journal of Chemical Physics|July 5, 2013
A simplified Tamm-Dancoff density functional approach for the electronic excitation spectra of very large moleculesStefan Grimme
Chemistry (Weinheim an Der Bergstrasse, Germany)|July 12, 2012
Supramolecular binding thermodynamics by dispersion-corrected density functional theoryStefan Grimme
Organic Letters|September 25, 2010
n-Alkane isodesmic reaction energy errors in density functional theory are due to electron correlation effectsStefan Grimme
The Journal of Physical Chemistry. A|July 13, 2006
Accurate calculation of the heats of formation for large main group compounds with spin-component scaled MP2 methodsStefan Grimme
Angewandte Chemie (International Ed. in English)|June 2, 2006
Seemingly simple stereoelectronic effects in alkane isomers and the implications for Kohn-Sham density functional theoryStefan Grimme
Chemistry (Weinheim an Der Bergstrasse, Germany)|July 15, 2004
On the importance of electron correlation effects for the pi-pi interactions in cyclophanesStefan Grimme
Journal of Computational Chemistry|June 30, 2004
Accurate description of van der Waals complexes by density functional theory including empirical correctionsStefan Grimme
The Journal of Chemical Physics|January 28, 2006
Semiempirical hybrid density functional with perturbative second-order correlationStefan Grimme
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry|March 22, 2012
Comment on: "On the accuracy of DFT methods in reproducing ligand substitution energies for transition metal complexes in solution: the role of dispersive interactions" by H. Jacobsen and L. CavalloStefan Grimme
Pageof 56

Showing results (1-10 of 552) with videos related to

Sort By:
Pageof 56
Angewandte Chemie (International Ed. in English)|May 1, 2013
Towards first principles calculation of electron impact mass spectra of moleculesStefan Grimme
The Journal of Chemical Physics|July 5, 2013
A simplified Tamm-Dancoff density functional approach for the electronic excitation spectra of very large moleculesStefan Grimme
Chemistry (Weinheim an Der Bergstrasse, Germany)|July 12, 2012
Supramolecular binding thermodynamics by dispersion-corrected density functional theoryStefan Grimme
Organic Letters|September 25, 2010
n-Alkane isodesmic reaction energy errors in density functional theory are due to electron correlation effectsStefan Grimme
The Journal of Physical Chemistry. A|July 13, 2006
Accurate calculation of the heats of formation for large main group compounds with spin-component scaled MP2 methodsStefan Grimme
Angewandte Chemie (International Ed. in English)|June 2, 2006
Seemingly simple stereoelectronic effects in alkane isomers and the implications for Kohn-Sham density functional theoryStefan Grimme
Chemistry (Weinheim an Der Bergstrasse, Germany)|July 15, 2004
On the importance of electron correlation effects for the pi-pi interactions in cyclophanesStefan Grimme
Journal of Computational Chemistry|June 30, 2004
Accurate description of van der Waals complexes by density functional theory including empirical correctionsStefan Grimme
The Journal of Chemical Physics|January 28, 2006
Semiempirical hybrid density functional with perturbative second-order correlationStefan Grimme
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry|March 22, 2012
Comment on: "On the accuracy of DFT methods in reproducing ligand substitution energies for transition metal complexes in solution: the role of dispersive interactions" by H. Jacobsen and L. CavalloStefan Grimme
Pageof 56