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The Journal of Chemical Physics
|
March 3, 2026
Publisher's Note: "'Ensemblization' of density functional theory" [J. Chem. Phys. 164, 040901 (2026)]
Tim Gould, Leeor Kronik, Stefano Pittalis
Physical Chemistry Chemical Physics : PCCP
|
April 10, 2024
Deep Mind 21 functional does not extrapolate to transition metal chemistry
Heng Zhao, Tim Gould, Stefan Vuckovic
The Journal of Chemical Physics
|
May 10, 2018
Charge transfer excitations from exact and approximate ensemble Kohn-Sham theory
Tim Gould, Leeor Kronik, Stefano Pittalis
The Journal of Chemical Physics
|
January 30, 2026
"Ensemblization" of density functional theory
Tim Gould, Leeor Kronik, Stefano Pittalis
Journal of Physics. Condensed Matter : an Institute of Physics Journal
|
December 17, 2024
Perturbative ensemble density functional theory applied to charge transfer excitations
Gil S Amoyal, Leeor Kronik, Tim Gould
Journal of Physics. Condensed Matter : an Institute of Physics Journal
|
October 15, 2013
Dispersion corrections in graphenic systems: a simple and effective model of binding
Tim Gould, S Lebègue, John F Dobson
The Journal of Comparative Neurology
|
April 1, 2011
Anatomical and sensory experiential determinants of synaptic plasticity in layer 2/3 pyramidal neurons of mouse barrel cortex
Neil R Hardingham, Tim Gould, Kevin Fox
Beilstein Journal of Organic Chemistry
|
July 7, 2018
Are dispersion corrections accurate outside equilibrium? A case study on benzene
Tim Gould, Erin R Johnson, Sherif Abdulkader Tawfik
Physical Chemistry Chemical Physics : PCCP
|
September 23, 2020
Establishing the accuracy of density functional approaches for the description of noncovalent interactions in biomolecules
Minho Kim, Tim Gould, Dario Rocca, et al.
The Journal of Chemical Physics
|
August 8, 2016
Locality of correlation in density functional theory
Kieron Burke, Antonio Cancio, Tim Gould, et al.
Page
of 6
Search research articles
Search
Showing results (21-30 of 60) with videos related to
Sort By:
Page
of 6
The Journal of Chemical Physics
|
March 3, 2026
Publisher's Note: "'Ensemblization' of density functional theory" [J. Chem. Phys. 164, 040901 (2026)]
Tim Gould, Leeor Kronik, Stefano Pittalis
Physical Chemistry Chemical Physics : PCCP
|
April 10, 2024
Deep Mind 21 functional does not extrapolate to transition metal chemistry
Heng Zhao, Tim Gould, Stefan Vuckovic
The Journal of Chemical Physics
|
May 10, 2018
Charge transfer excitations from exact and approximate ensemble Kohn-Sham theory
Tim Gould, Leeor Kronik, Stefano Pittalis
The Journal of Chemical Physics
|
January 30, 2026
"Ensemblization" of density functional theory
Tim Gould, Leeor Kronik, Stefano Pittalis
Journal of Physics. Condensed Matter : an Institute of Physics Journal
|
December 17, 2024
Perturbative ensemble density functional theory applied to charge transfer excitations
Gil S Amoyal, Leeor Kronik, Tim Gould
Journal of Physics. Condensed Matter : an Institute of Physics Journal
|
October 15, 2013
Dispersion corrections in graphenic systems: a simple and effective model of binding
Tim Gould, S Lebègue, John F Dobson
The Journal of Comparative Neurology
|
April 1, 2011
Anatomical and sensory experiential determinants of synaptic plasticity in layer 2/3 pyramidal neurons of mouse barrel cortex
Neil R Hardingham, Tim Gould, Kevin Fox
Beilstein Journal of Organic Chemistry
|
July 7, 2018
Are dispersion corrections accurate outside equilibrium? A case study on benzene
Tim Gould, Erin R Johnson, Sherif Abdulkader Tawfik
Physical Chemistry Chemical Physics : PCCP
|
September 23, 2020
Establishing the accuracy of density functional approaches for the description of noncovalent interactions in biomolecules
Minho Kim, Tim Gould, Dario Rocca, et al.
The Journal of Chemical Physics
|
August 8, 2016
Locality of correlation in density functional theory
Kieron Burke, Antonio Cancio, Tim Gould, et al.
Page
of 6