Coupling Natural Orbital Functional Theory and Many-Body Perturbation Theory by Using Nondynamically Correlated Canonical Orbitals

  1. Rodríguez-Mayorga, M.
  2. Mitxelena, I.
  3. Bruneval, F.
  4. Piris, M.
Journal:
Journal of Chemical Theory and Computation

ISSN: 1549-9626 1549-9618

Year of publication: 2021

Volume: 17

Issue: 12

Pages: 7562-7574

Type: Article

DOI: 10.1021/ACS.JCTC.1C00858 GOOGLE SCHOLAR
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