Model Hessian for accelerating first-principles structure optimizations

  1. Fernández-Serra, M.V.
  2. Artacho, E.
  3. Soler, J.M.
Revue:
Physical Review B - Condensed Matter and Materials Physics

ISSN: 1550-235X 1098-0121

Année de publication: 2003

Volumen: 67

Número: 10

Type: Article

DOI: 10.1103/PHYSREVB.67.100101 GOOGLE SCHOLAR