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S B Trickey

Showing results (21-30 of 35) with videos related to

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The Journal of Chemical Physics|July 16, 2008
Predictive first-principles simulations of strain-induced phenomena at water-silica nanotube interfacesYao He, Chao Cao, S B Trickey, et al.
Nature|December 16, 2021
On the liquid-liquid phase transition of dense hydrogenValentin V Karasiev, Joshua Hinz, S X Hu, et al.
The Journal of Chemical Physics|February 10, 2015
Generalized gradient approximation exchange energy functional with correct asymptotic behavior of the corresponding potentialJavier Carmona-Espíndola, José L Gázquez, Alberto Vela, et al.
Journal of Chemical Theory and Computation|November 28, 2018
Generalized Gradient Approximation Exchange Energy Functional with Near-Best Semilocal PerformanceJavier Carmona-Espíndola, José L Gázquez, Alberto Vela, et al.
The Journal of Physical Chemistry. A|January 25, 2020
Negative Electron Affinities and Derivative Discontinuity Contribution from a Generalized Gradient Approximation Exchange FunctionalJavier Carmona-Espíndola, José L Gázquez, Alberto Vela, et al.
The Journal of Chemical Physics|July 27, 2012
Scalable properties of metal clusters: a comparative study of modern exchange-correlation functionalsRalph Koitz, Thomas M Soini, Alexander Genest, et al.
The Journal of Chemical Physics|June 16, 2023
All-electron APW+lo calculation of magnetic molecules with the SIRIUS domain-specific packageLong Zhang, Anton Kozhevnikov, Thomas Schulthess, et al.
The Journal of Chemical Physics|March 20, 2012
Non-empirical improvement of PBE and its hybrid PBE0 for general description of molecular propertiesJorge M del Campo, José L Gázquez, S B Trickey, et al.
The Journal of Chemical Physics|October 15, 2022
Publisher's Note: "Hardness of molecules and bandgap of solids from a generalized gradient approximation exchange energy functional" [J. Chem. Phys. 157, 114109 (2022)]Javier Carmona-Espíndola, Anaid Flores, José L Gázquez, et al.
The Journal of Chemical Physics|September 22, 2022
Hardness of molecules and bandgap of solids from a generalized gradient approximation exchange energy functionalJavier Carmona-Espíndola, Anaid Flores, José L Gázquez, et al.
Pageof 4

Showing results (21-30 of 35) with videos related to

Sort By:
Pageof 4
The Journal of Chemical Physics|July 16, 2008
Predictive first-principles simulations of strain-induced phenomena at water-silica nanotube interfacesYao He, Chao Cao, S B Trickey, et al.
Nature|December 16, 2021
On the liquid-liquid phase transition of dense hydrogenValentin V Karasiev, Joshua Hinz, S X Hu, et al.
The Journal of Chemical Physics|February 10, 2015
Generalized gradient approximation exchange energy functional with correct asymptotic behavior of the corresponding potentialJavier Carmona-Espíndola, José L Gázquez, Alberto Vela, et al.
Journal of Chemical Theory and Computation|November 28, 2018
Generalized Gradient Approximation Exchange Energy Functional with Near-Best Semilocal PerformanceJavier Carmona-Espíndola, José L Gázquez, Alberto Vela, et al.
The Journal of Physical Chemistry. A|January 25, 2020
Negative Electron Affinities and Derivative Discontinuity Contribution from a Generalized Gradient Approximation Exchange FunctionalJavier Carmona-Espíndola, José L Gázquez, Alberto Vela, et al.
The Journal of Chemical Physics|July 27, 2012
Scalable properties of metal clusters: a comparative study of modern exchange-correlation functionalsRalph Koitz, Thomas M Soini, Alexander Genest, et al.
The Journal of Chemical Physics|June 16, 2023
All-electron APW+lo calculation of magnetic molecules with the SIRIUS domain-specific packageLong Zhang, Anton Kozhevnikov, Thomas Schulthess, et al.
The Journal of Chemical Physics|March 20, 2012
Non-empirical improvement of PBE and its hybrid PBE0 for general description of molecular propertiesJorge M del Campo, José L Gázquez, S B Trickey, et al.
The Journal of Chemical Physics|October 15, 2022
Publisher's Note: "Hardness of molecules and bandgap of solids from a generalized gradient approximation exchange energy functional" [J. Chem. Phys. 157, 114109 (2022)]Javier Carmona-Espíndola, Anaid Flores, José L Gázquez, et al.
The Journal of Chemical Physics|September 22, 2022
Hardness of molecules and bandgap of solids from a generalized gradient approximation exchange energy functionalJavier Carmona-Espíndola, Anaid Flores, José L Gázquez, et al.
Pageof 4