Force calculation and atomic-structure optimization for the full-potential linearized augmented plane-wave code WIEN

Research output: Contribution to journalArticleResearchpeer-review

Authors

  • Bernd Kohler
  • Steffen Wilke
  • Matthias Scheffler
  • Robert Kouba
  • Claudia Draxl

Details

Translated title of the contributionForce calculation and atomic-structure optimization for the full-potential linearized augmented plane-wave code WIEN
Original languageEnglish
Pages (from-to)31-47
JournalComputer physics communications
Volume94
Publication statusPublished - 1996