Comparison of empirical bond-valence and first-principles energy calculations for a complex structural instability

  1. Etxebarria, I.
  2. Perez-Mato, J.M.
  3. García, A.
  4. Blaha, P.
  5. Schwarz, K.
  6. Rodriguez-Carvajal, J.
Journal:
Physical Review B - Condensed Matter and Materials Physics

ISSN: 1098-0121,  1550-235X

Year of publication: 2005

Volume: 72

Issue: 17

Type: Article

DOI: 10.1103/PHYSREVB.72.174108 GOOGLE SCHOLAR
Data source: Scopus