Assessment of a combined QM/MM approach for the study of large nitroxide systems in vacuo and in condensed phases

  1. Barone, V.
  2. Bencini, A.
  3. Cossi, M.
  4. Di Matteo, A.
  5. Mattesini, M.
  6. Totti, F.
Journal:
Journal of the American Chemical Society

ISSN: 0002-7863

Year of publication: 1998

Volume: 120

Issue: 28

Pages: 7069-7078

Type: Article

DOI: 10.1021/JA981079Z GOOGLE SCHOLAR
Data source: Scopus