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The Journal of Chemical Physics
|
May 5, 2007
Quantum Monte Carlo study of first-row atoms using transcorrelated variational Monte Carlo trial functions
Rajendra Prasad, Naoto Umezawa, Dominik Domin, et al.
The Journal of Chemical Physics
|
January 30, 2021
Probing the structural properties of the water solvation shell around gold nanoparticles: A computational study
Rika Tandiana, Emilie Brun, Cécile Sicard-Roselli, et al.
The Journal of Physical Chemistry. B
|
July 5, 2017
Coupled Valence-Bond State Molecular Dynamics Description of an Enzyme-Catalyzed Reaction in a Non-Aqueous Organic Solvent
Elise Duboué-Dijon, Eva Pluhařová, Dominik Domin, et al.
Physical Chemistry Chemical Physics : PCCP
|
April 1, 2020
The statistical molecular fragmentation model compared to experimental plasma induced hydrocarbon decays
Pierre Désesquelles, Stéphane Pasquiers, Nicole Blin-Simiand, et al.
The Journal of Physical Chemistry. A
|
September 10, 2010
A diffusion Monte Carlo study of the O-H bond dissociation of phenol
Jinhua Wang, Dominik Domin, Brian Austin, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
September 3, 2025
Accelerating the Structure Exploration of Diverse Bi-Pt Nanoclusters via Physics-Informed Machine Learning Potential and Particle Swarm Optimization
Raphaël Vangheluwe, Carine Clavaguéra, Minh-Tue Truong, et al.
Physical Chemistry Chemical Physics : PCCP
|
April 28, 2021
Multiple dehydrogenation of fluorene cation and neutral fluorene using the statistical molecular fragmentation model
Pierre Désesquelles, Nguyen-Thi Van-Oanh, Lejin Xu, et al.
Journal of Computational Chemistry
|
April 9, 2005
Zori 1.0: a parallel quantum Monte Carlo electronic structure package
Alán Aspuru-Guzik, Romelia Salomón-Ferrer, Brian Austin, et al.
Page
of 2
Search research articles
Search
Showing results (11-20 of 18) with videos related to
Sort By:
Page
of 2
You have reached the last page of results.
This site can display upto 18 results.
The Journal of Chemical Physics
|
May 5, 2007
Quantum Monte Carlo study of first-row atoms using transcorrelated variational Monte Carlo trial functions
Rajendra Prasad, Naoto Umezawa, Dominik Domin, et al.
The Journal of Chemical Physics
|
January 30, 2021
Probing the structural properties of the water solvation shell around gold nanoparticles: A computational study
Rika Tandiana, Emilie Brun, Cécile Sicard-Roselli, et al.
The Journal of Physical Chemistry. B
|
July 5, 2017
Coupled Valence-Bond State Molecular Dynamics Description of an Enzyme-Catalyzed Reaction in a Non-Aqueous Organic Solvent
Elise Duboué-Dijon, Eva Pluhařová, Dominik Domin, et al.
Physical Chemistry Chemical Physics : PCCP
|
April 1, 2020
The statistical molecular fragmentation model compared to experimental plasma induced hydrocarbon decays
Pierre Désesquelles, Stéphane Pasquiers, Nicole Blin-Simiand, et al.
The Journal of Physical Chemistry. A
|
September 10, 2010
A diffusion Monte Carlo study of the O-H bond dissociation of phenol
Jinhua Wang, Dominik Domin, Brian Austin, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
September 3, 2025
Accelerating the Structure Exploration of Diverse Bi-Pt Nanoclusters via Physics-Informed Machine Learning Potential and Particle Swarm Optimization
Raphaël Vangheluwe, Carine Clavaguéra, Minh-Tue Truong, et al.
Physical Chemistry Chemical Physics : PCCP
|
April 28, 2021
Multiple dehydrogenation of fluorene cation and neutral fluorene using the statistical molecular fragmentation model
Pierre Désesquelles, Nguyen-Thi Van-Oanh, Lejin Xu, et al.
Journal of Computational Chemistry
|
April 9, 2005
Zori 1.0: a parallel quantum Monte Carlo electronic structure package
Alán Aspuru-Guzik, Romelia Salomón-Ferrer, Brian Austin, et al.
Page
of 2