Electron Correlation in the Iron(II) Porphyrin by Natural Orbital Functional Approximations

  1. Lew-Yee, J.F.H.
  2. del Campo, J.M.
  3. Piris, M.
Journal:
Journal of Chemical Theory and Computation

ISSN: 1549-9626 1549-9618

Year of publication: 2023

Volume: 19

Issue: 1

Pages: 211-220

Type: Article

DOI: 10.1021/ACS.JCTC.2C01093 GOOGLE SCHOLAR