Minimal Basis Set Hartree–Fock Corrected with Atom-Centered Potentials for Molecular Crystal Modeling and Crystal Structure Prediction

Author:

Tuca Emilian1ORCID,DiLabio Gino1ORCID,Otero-de-la-Roza Alberto2ORCID

Affiliation:

1. Department of Chemistry, University of British Columbia, Okanagan, 3247 University Way, Kelowna V1 V 1 V7, British Columbia, Canada

2. Departamento de Química Física y Analítica and MALTA-Consolider Team, Facultad de Química, Universidad de Oviedo, 33006 Oviedo, Spain

Funder

Canada Foundation for Innovation

Ministerio de Ciencia e Innovaci?n

European Regional Development Fund

Ministerio de Econom?a y Competitividad

Fundaci?n para el Fomento en Asturias de la Investigaci?n Cient?fica Aplicada y la Tecnolog?a

Natural Sciences and Engineering Research Council of Canada

British Columbia Knowledge Development Fund

Publisher

American Chemical Society (ACS)

Subject

Library and Information Sciences,Computer Science Applications,General Chemical Engineering,General Chemistry

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