Simulations of minerals using density-functional theory based on atomic orbitals for linear scaling

  1. Craig, M.S.
  2. Warren, C.M.
  3. Dove, T.M.
  4. Gale, J.D.
  5. Sanchez-Portal, D.
  6. Ordejon, P.
  7. Soler, J.M.
  8. Artacho, E.
Journal:
Physics and Chemistry of Minerals

ISSN: 0342-1791

Year of publication: 2004

Volume: 31

Issue: 1

Pages: 12-21

Type: Article

DOI: 10.1007/S00269-002-0268-0 GOOGLE SCHOLAR
Data source: Scopus