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Marcel Swart

Showing results (21-30 of 123) with videos related to

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The Journal of Physical Chemistry. A|March 29, 2011
Dispersion corrections essential for the study of chemical reactivity in fullerenesSílvia Osuna, Marcel Swart, Miquel Solà
The Journal of Chemical Physics|September 11, 2009
A new all-round density functional based on spin states and S(N)2 barriersMarcel Swart, Miquel Solà, F Matthias Bickelhaupt
Bioorganic & Medicinal Chemistry|November 3, 2005
Theoretical study of structure, pKa, lipophilicity, solubility, absorption, and polar surface area of some centrally acting antihypertensivesMilan Remko, Marcel Swart, F Matthias Bickelhaupt
Inorganic Chemistry|December 10, 2016
Electrochemical Polymerization of Iron(III) Polypyridyl Complexes through C-C Coupling of Redox Non-innocent Phenolato LigandsDuenpen Unjaroen, Marcel Swart, Wesley R Browne
Journal of Computational Chemistry|March 10, 2011
Inter- and intramolecular dispersion interactionsMarcel Swart, Miquel Solà, F Matthias Bickelhaupt
Journal of Chemical Theory and Computation|December 1, 2015
Density Functional Calculations of E2 and SN2 Reactions: Effects of the Choice of Method, Algorithm, and Numerical AccuracyMarcel Swart, Miquel Solà, F Matthias Bickelhaupt
Journal of Computational Chemistry|March 8, 2007
Energy landscapes of nucleophilic substitution reactions: a comparison of density functional theory and coupled cluster methodsMarcel Swart, Miquel Solà, F Matthias Bickelhaupt
The Journal of Physical Chemistry. B|February 14, 2007
Conformational behavior of basic monomeric building units of glycosaminoglycans: isolated systems and solvent effectMilan Remko, Marcel Swart, F Matthias Bickelhaupt
Journal of Computational Chemistry|July 11, 2006
Proton affinities of maingroup-element hydrides and noble gases: trends across the periodic table, structural effects, and DFT validationMarcel Swart, Ernst Rösler, F Matthias Bickelhaupt
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry|November 26, 2013
Indenyl effect due to metal slippage? Computational exploration of rhodium-catalyzed acetylene [2+2+2] cyclotrimerizationLaura Orian, Marcel Swart, F Matthias Bickelhaupt
Pageof 13

Showing results (21-30 of 123) with videos related to

Sort By:
Pageof 13
The Journal of Physical Chemistry. A|March 29, 2011
Dispersion corrections essential for the study of chemical reactivity in fullerenesSílvia Osuna, Marcel Swart, Miquel Solà
The Journal of Chemical Physics|September 11, 2009
A new all-round density functional based on spin states and S(N)2 barriersMarcel Swart, Miquel Solà, F Matthias Bickelhaupt
Bioorganic & Medicinal Chemistry|November 3, 2005
Theoretical study of structure, pKa, lipophilicity, solubility, absorption, and polar surface area of some centrally acting antihypertensivesMilan Remko, Marcel Swart, F Matthias Bickelhaupt
Inorganic Chemistry|December 10, 2016
Electrochemical Polymerization of Iron(III) Polypyridyl Complexes through C-C Coupling of Redox Non-innocent Phenolato LigandsDuenpen Unjaroen, Marcel Swart, Wesley R Browne
Journal of Computational Chemistry|March 10, 2011
Inter- and intramolecular dispersion interactionsMarcel Swart, Miquel Solà, F Matthias Bickelhaupt
Journal of Chemical Theory and Computation|December 1, 2015
Density Functional Calculations of E2 and SN2 Reactions: Effects of the Choice of Method, Algorithm, and Numerical AccuracyMarcel Swart, Miquel Solà, F Matthias Bickelhaupt
Journal of Computational Chemistry|March 8, 2007
Energy landscapes of nucleophilic substitution reactions: a comparison of density functional theory and coupled cluster methodsMarcel Swart, Miquel Solà, F Matthias Bickelhaupt
The Journal of Physical Chemistry. B|February 14, 2007
Conformational behavior of basic monomeric building units of glycosaminoglycans: isolated systems and solvent effectMilan Remko, Marcel Swart, F Matthias Bickelhaupt
Journal of Computational Chemistry|July 11, 2006
Proton affinities of maingroup-element hydrides and noble gases: trends across the periodic table, structural effects, and DFT validationMarcel Swart, Ernst Rösler, F Matthias Bickelhaupt
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry|November 26, 2013
Indenyl effect due to metal slippage? Computational exploration of rhodium-catalyzed acetylene [2+2+2] cyclotrimerizationLaura Orian, Marcel Swart, F Matthias Bickelhaupt
Pageof 13