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Daniel G A Smith

Showing results (21-30 of 26) with videos related to

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Journal of Chemical Theory and Computation|May 11, 2017
Psi4 1.1: An Open-Source Electronic Structure Program Emphasizing Automation, Advanced Libraries, and InteroperabilityRobert M Parrish, Lori A Burns, Daniel G A Smith, et al.
Journal of Chemical Theory and Computation|May 18, 2018
Psi4NumPy: An Interactive Quantum Chemistry Programming Environment for Reference Implementations and Rapid DevelopmentDaniel G A Smith, Lori A Burns, Dominic A Sirianni, et al.
The Journal of Chemical Physics|July 17, 2020
The CECAM electronic structure library and the modular software development paradigmMicael J T Oliveira, Nick Papior, Yann Pouillon, et al.
The Journal of Chemical Physics|May 17, 2020
Psi4 1.4: Open-source software for high-throughput quantum chemistryDaniel G A Smith, Lori A Burns, Andrew C Simmonett, et al.
Biorxiv : the Preprint Server for Biology|November 24, 2021
#COVIDisAirborne: AI-Enabled Multiscale Computational Microscopy of Delta SARS-CoV-2 in a Respiratory AerosolAbigail Dommer, Lorenzo Casalino, Fiona Kearns, et al.
The Journal of Chemical Physics|December 2, 2021
Quantum Chemistry Common Driver and Databases (QCDB) and Quantum Chemistry Engine (QCEngine): Automation and interoperability among computational chemistry programsDaniel G A Smith, Annabelle T Lolinco, Zachary L Glick, et al.
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Showing results (21-30 of 26) with videos related to

Sort By:
Pageof 3
You have reached the last page of results.This site can display upto 26 results.
Journal of Chemical Theory and Computation|May 11, 2017
Psi4 1.1: An Open-Source Electronic Structure Program Emphasizing Automation, Advanced Libraries, and InteroperabilityRobert M Parrish, Lori A Burns, Daniel G A Smith, et al.
Journal of Chemical Theory and Computation|May 18, 2018
Psi4NumPy: An Interactive Quantum Chemistry Programming Environment for Reference Implementations and Rapid DevelopmentDaniel G A Smith, Lori A Burns, Dominic A Sirianni, et al.
The Journal of Chemical Physics|July 17, 2020
The CECAM electronic structure library and the modular software development paradigmMicael J T Oliveira, Nick Papior, Yann Pouillon, et al.
The Journal of Chemical Physics|May 17, 2020
Psi4 1.4: Open-source software for high-throughput quantum chemistryDaniel G A Smith, Lori A Burns, Andrew C Simmonett, et al.
Biorxiv : the Preprint Server for Biology|November 24, 2021
#COVIDisAirborne: AI-Enabled Multiscale Computational Microscopy of Delta SARS-CoV-2 in a Respiratory AerosolAbigail Dommer, Lorenzo Casalino, Fiona Kearns, et al.
The Journal of Chemical Physics|December 2, 2021
Quantum Chemistry Common Driver and Databases (QCDB) and Quantum Chemistry Engine (QCEngine): Automation and interoperability among computational chemistry programsDaniel G A Smith, Annabelle T Lolinco, Zachary L Glick, et al.
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