Atom-Centered Potentials with Dispersion-Corrected Minimal-Basis-Set Hartree–Fock: An Efficient and Accurate Computational Approach for Large Molecular Systems

Title
Atom-Centered Potentials with Dispersion-Corrected Minimal-Basis-Set Hartree–Fock: An Efficient and Accurate Computational Approach for Large Molecular Systems
Authors
Keywords
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Journal
Journal of Chemical Theory and Computation
Volume 14, Issue 2, Pages 726-738
Publisher
American Chemical Society (ACS)
Online
2017-12-21
DOI
10.1021/acs.jctc.7b01158

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