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Title:

Toward First-Principles-Level Polarization Energies in Force Fields: A Gaussian Basis for the Atom-Condensed Kohn–Sham Method

Document type:
Zeitschriftenaufsatz
Author(s):
Gütlein, Patrick; Lang, Lucas; Reuter, Karsten; Blumberger, Jochen; Oberhofer, Harald
Journal title:
Journal of Chemical Theory and Computation
Year:
2019
Journal volume:
15
Journal issue:
8
Pages contribution:
4516-4525
Fulltext / DOI:
doi:10.1021/acs.jctc.9b00415
Publisher:
American Chemical Society (ACS)
E-ISSN:
1549-96181549-9626
Date of publication:
21.06.2019
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