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The Journal of Chemical Physics
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February 25, 2014
Generalizing the self-healing diffusion Monte Carlo approach to finite temperature: a path for the optimization of low-energy many-body bases
Fernando A Reboredo, Jeongnim Kim
Journal of Chemical Theory and Computation
|
December 1, 2025
A High-Efficiency Delayed Update Algorithm for Evaluating Slater Determinants in Quantum Monte Carlo
Ye Luo, Jeongnim Kim, Paul R C Kent
The Journal of Chemical Physics
|
November 23, 2015
The transition to the metallic state in low density hydrogen
Jeremy McMinis, Miguel A Morales, David M Ceperley, et al.
The Journal of Chemical Physics
|
November 3, 2014
Successes and failures of Hubbard-corrected density functional theory: the case of Mg doped LiCoO2
Juan A Santana, Jeongnim Kim, P R C Kent, et al.
Journal of Chemical Theory and Computation
|
September 26, 2017
Nature of Interlayer Binding and Stacking of sp-sp<sup>2</sup> Hybridized Carbon Layers: A Quantum Monte Carlo Study
Hyeondeok Shin, Jeongnim Kim, Hoonkyung Lee, et al.
The Journal of Chemical Physics
|
January 10, 2012
Computing the energy of a water molecule using multideterminants: a simple, efficient algorithm
Bryan K Clark, Miguel A Morales, Jeremy McMinis, et al.
Journal of Chemical Theory and Computation
|
November 21, 2015
Application of Diffusion Monte Carlo to Materials Dominated by van der Waals Interactions
Anouar Benali, Luke Shulenburger, Nichols A Romero, et al.
The Journal of Chemical Physics
|
March 25, 2014
Cohesion energetics of carbon allotropes: quantum Monte Carlo study
Hyeondeok Shin, Sinabro Kang, Jahyun Koo, et al.
The Journal of Chemical Physics
|
December 3, 2008
Molecular hydrogen adsorbed on benzene: Insights from a quantum Monte Carlo study
Todd D Beaudet, Michele Casula, Jeongnim Kim, et al.
Journal of Chemical Theory and Computation
|
November 22, 2015
Multideterminant Wave Functions in Quantum Monte Carlo
Miguel A Morales, Jeremy McMinis, Bryan K Clark, et al.
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of 2
Search research articles
Search
Showing results (1-10 of 17) with videos related to
Sort By:
Page
of 2
The Journal of Chemical Physics
|
February 25, 2014
Generalizing the self-healing diffusion Monte Carlo approach to finite temperature: a path for the optimization of low-energy many-body bases
Fernando A Reboredo, Jeongnim Kim
Journal of Chemical Theory and Computation
|
December 1, 2025
A High-Efficiency Delayed Update Algorithm for Evaluating Slater Determinants in Quantum Monte Carlo
Ye Luo, Jeongnim Kim, Paul R C Kent
The Journal of Chemical Physics
|
November 23, 2015
The transition to the metallic state in low density hydrogen
Jeremy McMinis, Miguel A Morales, David M Ceperley, et al.
The Journal of Chemical Physics
|
November 3, 2014
Successes and failures of Hubbard-corrected density functional theory: the case of Mg doped LiCoO2
Juan A Santana, Jeongnim Kim, P R C Kent, et al.
Journal of Chemical Theory and Computation
|
September 26, 2017
Nature of Interlayer Binding and Stacking of sp-sp<sup>2</sup> Hybridized Carbon Layers: A Quantum Monte Carlo Study
Hyeondeok Shin, Jeongnim Kim, Hoonkyung Lee, et al.
The Journal of Chemical Physics
|
January 10, 2012
Computing the energy of a water molecule using multideterminants: a simple, efficient algorithm
Bryan K Clark, Miguel A Morales, Jeremy McMinis, et al.
Journal of Chemical Theory and Computation
|
November 21, 2015
Application of Diffusion Monte Carlo to Materials Dominated by van der Waals Interactions
Anouar Benali, Luke Shulenburger, Nichols A Romero, et al.
The Journal of Chemical Physics
|
March 25, 2014
Cohesion energetics of carbon allotropes: quantum Monte Carlo study
Hyeondeok Shin, Sinabro Kang, Jahyun Koo, et al.
The Journal of Chemical Physics
|
December 3, 2008
Molecular hydrogen adsorbed on benzene: Insights from a quantum Monte Carlo study
Todd D Beaudet, Michele Casula, Jeongnim Kim, et al.
Journal of Chemical Theory and Computation
|
November 22, 2015
Multideterminant Wave Functions in Quantum Monte Carlo
Miguel A Morales, Jeremy McMinis, Bryan K Clark, et al.
Page
of 2