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Physical Chemistry Chemical Physics : PCCP
|
October 22, 2020
Quantum simulation of electronic structure with a transcorrelated Hamiltonian: improved accuracy with a smaller footprint on the quantum computer
Mario Motta, Tanvi P Gujarati, Julia E Rice, et al.
Journal of Computational Chemistry
|
April 11, 2007
PSI3: an open-source Ab Initio electronic structure package
T Daniel Crawford, C David Sherrill, Edward F Valeev, et al.
The Journal of Chemical Physics
|
August 6, 2020
Massively Parallel Quantum Chemistry: A high-performance research platform for electronic structure
Chong Peng, Cannada A Lewis, Xiao Wang, et al.
Nature Communications
|
April 7, 2023
Evaluating the evidence for exponential quantum advantage in ground-state quantum chemistry
Seunghoon Lee, Joonho Lee, Huanchen Zhai, et al.
Journal of Chemical Theory and Computation
|
September 28, 2023
A Perspective on Sustainable Computational Chemistry Software Development and Integration
Rosa Di Felice, Maricris L Mayes, Ryan M Richard, et al.
Chemical Reviews
|
March 31, 2021
From NWChem to NWChemEx: Evolving with the Computational Chemistry Landscape
Karol Kowalski, Raymond Bair, Nicholas P Bauman, et al.
Journal of Chemical Theory and Computation
|
May 11, 2017
Psi4 1.1: An Open-Source Electronic Structure Program Emphasizing Automation, Advanced Libraries, and Interoperability
Robert M Parrish, Lori A Burns, Daniel G A Smith, et al.
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of 9
Search research articles
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Showing results (81-90 of 87) with videos related to
Sort By:
Page
of 9
You have reached the last page of results.
This site can display upto 87 results.
Physical Chemistry Chemical Physics : PCCP
|
October 22, 2020
Quantum simulation of electronic structure with a transcorrelated Hamiltonian: improved accuracy with a smaller footprint on the quantum computer
Mario Motta, Tanvi P Gujarati, Julia E Rice, et al.
Journal of Computational Chemistry
|
April 11, 2007
PSI3: an open-source Ab Initio electronic structure package
T Daniel Crawford, C David Sherrill, Edward F Valeev, et al.
The Journal of Chemical Physics
|
August 6, 2020
Massively Parallel Quantum Chemistry: A high-performance research platform for electronic structure
Chong Peng, Cannada A Lewis, Xiao Wang, et al.
Nature Communications
|
April 7, 2023
Evaluating the evidence for exponential quantum advantage in ground-state quantum chemistry
Seunghoon Lee, Joonho Lee, Huanchen Zhai, et al.
Journal of Chemical Theory and Computation
|
September 28, 2023
A Perspective on Sustainable Computational Chemistry Software Development and Integration
Rosa Di Felice, Maricris L Mayes, Ryan M Richard, et al.
Chemical Reviews
|
March 31, 2021
From NWChem to NWChemEx: Evolving with the Computational Chemistry Landscape
Karol Kowalski, Raymond Bair, Nicholas P Bauman, et al.
Journal of Chemical Theory and Computation
|
May 11, 2017
Psi4 1.1: An Open-Source Electronic Structure Program Emphasizing Automation, Advanced Libraries, and Interoperability
Robert M Parrish, Lori A Burns, Daniel G A Smith, et al.
Page
of 9