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Journal of Chemical Theory and Computation|September 28, 2023
A Perspective on Sustainable Computational Chemistry Software Development and IntegrationRosa Di Felice, Maricris L Mayes, Ryan M Richard, et al.Chemical Reviews|March 31, 2021
From NWChem to NWChemEx: Evolving with the Computational Chemistry LandscapeKarol 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 InteroperabilityRobert M Parrish, Lori A Burns, Daniel G A Smith, et al.Pageof 9