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Journal of Chemical Theory and Computation
|
April 26, 2017
Fully Quantum Description of the Zundel Ion: Combining Variational Quantum Monte Carlo with Path Integral Langevin Dynamics
Félix Mouhat, Sandro Sorella, Rodolphe Vuilleumier, et al.
Journal of Chemical Theory and Computation
|
November 19, 2015
Quantum Monte Carlo Study of the Protonated Water Dimer
Mario Dagrada, Michele Casula, Antonino M Saitta, 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.
Nature Communications
|
November 15, 2017
Carbon nanotubes as excitonic insulators
Daniele Varsano, Sandro Sorella, Davide Sangalli, et al.
Physical Review Letters
|
August 25, 2018
Correlation-Driven Dimerization and Topological Gap Opening in Isotropically Strained Graphene
Sandro Sorella, Kazuhiro Seki, Oleg O Brovko, et al.
The Journal of Physical Chemistry. C, Nanomaterials and Interfaces
|
December 6, 2016
Toward Accurate Adsorption Energetics on Clay Surfaces
Andrea Zen, Loïc M Roch, Stephen J Cox, et al.
The Journal of Chemical Physics
|
June 4, 2020
TurboRVB: A many-body toolkit for ab initio electronic simulations by quantum Monte Carlo
Kousuke Nakano, Claudio Attaccalite, Matteo Barborini, et al.
The Journal of Chemical Physics
|
May 5, 2023
TREXIO: A file format and library for quantum chemistry
Evgeny Posenitskiy, Vijay Gopal Chilkuri, Abdallah Ammar, et al.
Science (New York, N.Y.)
|
October 17, 2024
Variational benchmarks for quantum many-body problems
Dian Wu, Riccardo Rossi, Filippo Vicentini, et al.
The Journal of Chemical Physics
|
September 8, 2025
Reproducibility of fixed-node diffusion Monte Carlo across diverse community codes: The case of water-methane dimer
Flaviano Della Pia, Benjamin X Shi, Yasmine S Al-Hamdani, et al.
Page
of 5
Search research articles
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Showing results (41-50 of 50) with videos related to
Sort By:
Page
of 5
You have reached the last page of results.
This site can display upto 50 results.
Journal of Chemical Theory and Computation
|
April 26, 2017
Fully Quantum Description of the Zundel Ion: Combining Variational Quantum Monte Carlo with Path Integral Langevin Dynamics
Félix Mouhat, Sandro Sorella, Rodolphe Vuilleumier, et al.
Journal of Chemical Theory and Computation
|
November 19, 2015
Quantum Monte Carlo Study of the Protonated Water Dimer
Mario Dagrada, Michele Casula, Antonino M Saitta, 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.
Nature Communications
|
November 15, 2017
Carbon nanotubes as excitonic insulators
Daniele Varsano, Sandro Sorella, Davide Sangalli, et al.
Physical Review Letters
|
August 25, 2018
Correlation-Driven Dimerization and Topological Gap Opening in Isotropically Strained Graphene
Sandro Sorella, Kazuhiro Seki, Oleg O Brovko, et al.
The Journal of Physical Chemistry. C, Nanomaterials and Interfaces
|
December 6, 2016
Toward Accurate Adsorption Energetics on Clay Surfaces
Andrea Zen, Loïc M Roch, Stephen J Cox, et al.
The Journal of Chemical Physics
|
June 4, 2020
TurboRVB: A many-body toolkit for ab initio electronic simulations by quantum Monte Carlo
Kousuke Nakano, Claudio Attaccalite, Matteo Barborini, et al.
The Journal of Chemical Physics
|
May 5, 2023
TREXIO: A file format and library for quantum chemistry
Evgeny Posenitskiy, Vijay Gopal Chilkuri, Abdallah Ammar, et al.
Science (New York, N.Y.)
|
October 17, 2024
Variational benchmarks for quantum many-body problems
Dian Wu, Riccardo Rossi, Filippo Vicentini, et al.
The Journal of Chemical Physics
|
September 8, 2025
Reproducibility of fixed-node diffusion Monte Carlo across diverse community codes: The case of water-methane dimer
Flaviano Della Pia, Benjamin X Shi, Yasmine S Al-Hamdani, et al.
Page
of 5