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Axel D Becke

Showing results (31-40 of 38) with videos related to

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The Journal of Chemical Physics|April 24, 2023
A double-hybrid density functional based on good local physics with outstanding performance on the GMTKN55 databaseAxel D Becke, Golokesh Santra, Jan M L Martin
The Journal of Chemical Physics|June 10, 2018
Communication: Correct charge transfer in CT complexes from the Becke'05 density functionalAxel D Becke, Stephen G Dale, Erin R Johnson
Physical Chemistry Chemical Physics : PCCP|October 17, 2018
Density-functional description of alkalides: introducing the alkalide stateStephen G Dale, Axel D Becke, Erin R Johnson
The Journal of Chemical Physics|May 19, 2007
Density functionals and transition-metal atomsErin R Johnson, Ross M Dickson, Axel D Becke
The Journal of Chemical Physics|October 23, 2017
Interrogating the Becke'05 density functional for non-locality informationStephen G Dale, Erin R Johnson, Axel D Becke
The Journal of Chemical Physics|July 24, 2009
Oscillations in meta-generalized-gradient approximation potential energy surfaces for dispersion-bound complexesErin R Johnson, Axel D Becke, C David Sherrill, et al.
Angewandte Chemie (International Ed. in English)|September 25, 2018
Pervasive Delocalisation Error Causes Spurious Proton Transfer in Organic Acid-Base Co-CrystalsLuc M LeBlanc, Stephen G Dale, Christopher R Taylor, et al.
Journal of Computational Chemistry|September 13, 2019
Quantum Chemical Methods for Modeling Covalent Modification of Biological ThiolsErnest Awoonor-Williams, William C Isley, Stephen G Dale, et al.
Pageof 4

Showing results (31-40 of 38) with videos related to

Sort By:
Pageof 4
You have reached the last page of results.This site can display upto 38 results.
The Journal of Chemical Physics|April 24, 2023
A double-hybrid density functional based on good local physics with outstanding performance on the GMTKN55 databaseAxel D Becke, Golokesh Santra, Jan M L Martin
The Journal of Chemical Physics|June 10, 2018
Communication: Correct charge transfer in CT complexes from the Becke'05 density functionalAxel D Becke, Stephen G Dale, Erin R Johnson
Physical Chemistry Chemical Physics : PCCP|October 17, 2018
Density-functional description of alkalides: introducing the alkalide stateStephen G Dale, Axel D Becke, Erin R Johnson
The Journal of Chemical Physics|May 19, 2007
Density functionals and transition-metal atomsErin R Johnson, Ross M Dickson, Axel D Becke
The Journal of Chemical Physics|October 23, 2017
Interrogating the Becke'05 density functional for non-locality informationStephen G Dale, Erin R Johnson, Axel D Becke
The Journal of Chemical Physics|July 24, 2009
Oscillations in meta-generalized-gradient approximation potential energy surfaces for dispersion-bound complexesErin R Johnson, Axel D Becke, C David Sherrill, et al.
Angewandte Chemie (International Ed. in English)|September 25, 2018
Pervasive Delocalisation Error Causes Spurious Proton Transfer in Organic Acid-Base Co-CrystalsLuc M LeBlanc, Stephen G Dale, Christopher R Taylor, et al.
Journal of Computational Chemistry|September 13, 2019
Quantum Chemical Methods for Modeling Covalent Modification of Biological ThiolsErnest Awoonor-Williams, William C Isley, Stephen G Dale, et al.
Pageof 4