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The Journal of Chemical Physics
|
May 14, 2022
Piecewise interaction picture density matrix quantum Monte Carlo
William Z Van Benschoten, James J Shepherd
The Journal of Physical Chemistry. A
|
November 25, 2024
Removing Basis Set Incompleteness Error in Finite-Temperature Electronic Structure Calculations: Two-Electron Systems
William Z Van Benschoten, James J Shepherd
The Journal of Physical Chemistry. A
|
August 3, 2023
Electronic Free Energy Surface of the Nitrogen Dimer Using First-Principles Finite Temperature Electronic Structure Methods
William Z Van Benschoten, Hayley R Petras, James J Shepherd
The Journal of Chemical Physics
|
January 15, 2021
Accelerating convergence to the thermodynamic limit with twist angle selection applied to methods beyond many-body perturbation theory
Tina N Mihm, William Z Van Benschoten, James J Shepherd
The Journal of Chemical Physics
|
February 4, 2024
Sampling the reciprocal Coulomb potential in finite anisotropic cells
Tobias Schäfer, William Z Van Benschoten, James J Shepherd, et al.
Journal of Chemical Theory and Computation
|
September 21, 2021
The Sign Problem in Density Matrix Quantum Monte Carlo
Hayley R Petras, William Z Van Benschoten, Sai Kumar Ramadugu, et al.
The Journal of Chemical Physics
|
June 2, 2023
Electronic specific heat capacities and entropies from density matrix quantum Monte Carlo using Gaussian process regression to find gradients of noisy data
William Z Van Benschoten, Laura Weiler, Gabriel J Smith, et al.
Faraday Discussions
|
August 22, 2024
CO adsorption on Pt(111) studied by periodic coupled cluster theory
Johanna P Carbone, Andreas Irmler, Alejandro Gallo, et al.
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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
|
May 14, 2022
Piecewise interaction picture density matrix quantum Monte Carlo
William Z Van Benschoten, James J Shepherd
The Journal of Physical Chemistry. A
|
November 25, 2024
Removing Basis Set Incompleteness Error in Finite-Temperature Electronic Structure Calculations: Two-Electron Systems
William Z Van Benschoten, James J Shepherd
The Journal of Physical Chemistry. A
|
August 3, 2023
Electronic Free Energy Surface of the Nitrogen Dimer Using First-Principles Finite Temperature Electronic Structure Methods
William Z Van Benschoten, Hayley R Petras, James J Shepherd
The Journal of Chemical Physics
|
January 15, 2021
Accelerating convergence to the thermodynamic limit with twist angle selection applied to methods beyond many-body perturbation theory
Tina N Mihm, William Z Van Benschoten, James J Shepherd
The Journal of Chemical Physics
|
February 4, 2024
Sampling the reciprocal Coulomb potential in finite anisotropic cells
Tobias Schäfer, William Z Van Benschoten, James J Shepherd, et al.
Journal of Chemical Theory and Computation
|
September 21, 2021
The Sign Problem in Density Matrix Quantum Monte Carlo
Hayley R Petras, William Z Van Benschoten, Sai Kumar Ramadugu, et al.
The Journal of Chemical Physics
|
June 2, 2023
Electronic specific heat capacities and entropies from density matrix quantum Monte Carlo using Gaussian process regression to find gradients of noisy data
William Z Van Benschoten, Laura Weiler, Gabriel J Smith, et al.
Faraday Discussions
|
August 22, 2024
CO adsorption on Pt(111) studied by periodic coupled cluster theory
Johanna P Carbone, Andreas Irmler, Alejandro Gallo, et al.
Page
of 1