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The Journal of Chemical Physics
|
July 11, 2016
Communication: Energy transfer and reaction dynamics for DCl scattering on Au(111): An ab initio molecular dynamics study
Brian Kolb, Hua Guo
The Journal of Physical Chemistry. A
|
April 3, 2013
Binding interactions in dimers of phenalenyl and closed-shell analogues
Brian Kolb, Miklos Kertesz, T Thonhauser
Physical Chemistry Chemical Physics : PCCP
|
May 10, 2016
Control of valence and conduction band energies in layered transition metal phosphates via surface functionalization
Levi C Lentz, Brian Kolb, Alexie M Kolpak
Scientific Reports
|
April 28, 2017
Discovering charge density functionals and structure-property relationships with PROPhet: A general framework for coupling machine learning and first-principles methods
Brian Kolb, Levi C Lentz, Alexie M Kolpak
The Journal of Chemical Physics
|
June 17, 2016
Permutation invariant potential energy surfaces for polyatomic reactions using atomistic neural networks
Brian Kolb, Bin Zhao, Jun Li, et al.
The Journal of Physical Chemistry Letters
|
January 20, 2017
High-Dimensional Atomistic Neural Network Potentials for Molecule-Surface Interactions: HCl Scattering from Au(111)
Brian Kolb, Xuan Luo, Xueyao Zhou, et al.
The Journal of Physical Chemistry. A
|
March 14, 2017
Representing Global Reactive Potential Energy Surfaces Using Gaussian Processes
Brian Kolb, Paul Marshall, Bin Zhao, et al.
Journal of Physics. Condensed Matter : an Institute of Physics Journal
|
October 4, 2012
Structural evolution of amino acid crystals under stress from a non-empirical density functional
Riccardo Sabatini, Emine Küçükbenli, Brian Kolb, et al.
Page
of 1
Search research articles
Search
Showing results (1-10 of 8) with videos related to
Sort By:
Page
of 1
The Journal of Chemical Physics
|
July 11, 2016
Communication: Energy transfer and reaction dynamics for DCl scattering on Au(111): An ab initio molecular dynamics study
Brian Kolb, Hua Guo
The Journal of Physical Chemistry. A
|
April 3, 2013
Binding interactions in dimers of phenalenyl and closed-shell analogues
Brian Kolb, Miklos Kertesz, T Thonhauser
Physical Chemistry Chemical Physics : PCCP
|
May 10, 2016
Control of valence and conduction band energies in layered transition metal phosphates via surface functionalization
Levi C Lentz, Brian Kolb, Alexie M Kolpak
Scientific Reports
|
April 28, 2017
Discovering charge density functionals and structure-property relationships with PROPhet: A general framework for coupling machine learning and first-principles methods
Brian Kolb, Levi C Lentz, Alexie M Kolpak
The Journal of Chemical Physics
|
June 17, 2016
Permutation invariant potential energy surfaces for polyatomic reactions using atomistic neural networks
Brian Kolb, Bin Zhao, Jun Li, et al.
The Journal of Physical Chemistry Letters
|
January 20, 2017
High-Dimensional Atomistic Neural Network Potentials for Molecule-Surface Interactions: HCl Scattering from Au(111)
Brian Kolb, Xuan Luo, Xueyao Zhou, et al.
The Journal of Physical Chemistry. A
|
March 14, 2017
Representing Global Reactive Potential Energy Surfaces Using Gaussian Processes
Brian Kolb, Paul Marshall, Bin Zhao, et al.
Journal of Physics. Condensed Matter : an Institute of Physics Journal
|
October 4, 2012
Structural evolution of amino acid crystals under stress from a non-empirical density functional
Riccardo Sabatini, Emine Küçükbenli, Brian Kolb, et al.
Page
of 1