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F De Proft

Showing results (1-10 of 37) with videos related to

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Chemical Reviews|November 17, 2001
Conceptual and computational DFT in the study of aromaticityF De Proft, P Geerlings
Physical Chemistry Chemical Physics : PCCP|August 9, 2008
Conceptual DFT: the chemical relevance of higher response functionsP Geerlings, F De Proft
Physical Chemistry Chemical Physics : PCCP|March 7, 2014
Exploring the structure-aromaticity relationship in Hückel and Möbius N-fused pentaphyrins using DFTM Alonso, P Geerlings, F De Proft
Chemical Reviews|May 15, 2003
Conceptual density functional theoryP Geerlings, F De Proft, W Langenaeker
The Journal of Chemical Physics|September 17, 2005
Generalized nuclear Fukui functions in the framework of spin-polarized density-functional theoryE Chamorro, F De Proft, P Geerlings
The Journal of Chemical Physics|February 8, 2006
Philicity indices within the spin-polarized density-functional theory frameworkE Chamorro, P Pérez, F De Proft, et al.
The Journal of Physical Chemistry. A|July 21, 2006
A computational and conceptual density functional theory study of the properties of Re and Tc tricarbonyl complexesB Safi, J Mertens, F De Proft, et al.
The Journal of Organic Chemistry|January 25, 2008
Theoretical study of the orientation rules in photonucleophilic aromatic substitutionsB Pintér, F De Proft, T Veszprémi, et al.
Chemical Science|December 9, 2017
Revealing the thermodynamic driving force for ligand-based reductions in quinoids; conceptual rules for designing redox active and non-innocent ligandsG Skara, B Pinter, P Geerlings, et al.
The Journal of Chemical Physics|June 24, 2010
Nonuniqueness of magnetic fields and energy derivatives in spin-polarized density functional theoryT Gál, P W Ayers, F De Proft, et al.
Pageof 4

Showing results (1-10 of 37) with videos related to

Sort By:
Pageof 4
Chemical Reviews|November 17, 2001
Conceptual and computational DFT in the study of aromaticityF De Proft, P Geerlings
Physical Chemistry Chemical Physics : PCCP|August 9, 2008
Conceptual DFT: the chemical relevance of higher response functionsP Geerlings, F De Proft
Physical Chemistry Chemical Physics : PCCP|March 7, 2014
Exploring the structure-aromaticity relationship in Hückel and Möbius N-fused pentaphyrins using DFTM Alonso, P Geerlings, F De Proft
Chemical Reviews|May 15, 2003
Conceptual density functional theoryP Geerlings, F De Proft, W Langenaeker
The Journal of Chemical Physics|September 17, 2005
Generalized nuclear Fukui functions in the framework of spin-polarized density-functional theoryE Chamorro, F De Proft, P Geerlings
The Journal of Chemical Physics|February 8, 2006
Philicity indices within the spin-polarized density-functional theory frameworkE Chamorro, P Pérez, F De Proft, et al.
The Journal of Physical Chemistry. A|July 21, 2006
A computational and conceptual density functional theory study of the properties of Re and Tc tricarbonyl complexesB Safi, J Mertens, F De Proft, et al.
The Journal of Organic Chemistry|January 25, 2008
Theoretical study of the orientation rules in photonucleophilic aromatic substitutionsB Pintér, F De Proft, T Veszprémi, et al.
Chemical Science|December 9, 2017
Revealing the thermodynamic driving force for ligand-based reductions in quinoids; conceptual rules for designing redox active and non-innocent ligandsG Skara, B Pinter, P Geerlings, et al.
The Journal of Chemical Physics|June 24, 2010
Nonuniqueness of magnetic fields and energy derivatives in spin-polarized density functional theoryT Gál, P W Ayers, F De Proft, et al.
Pageof 4