CIF2Cell: Generating geometries for electronic structure programs

Torbjörn Björkman

Research output: Contribution to journalArticleScientificpeer-review

67 Citations (Scopus)
Original languageEnglish
Pages (from-to)1183
JournalComputer Physics Communications
Volume182
Issue number5
DOIs
Publication statusPublished - 2011
MoE publication typeA1 Journal article-refereed

Keywords

  • Crystallographic databases
  • Crystallography
  • Electron density of states and band structure of crystalline solids
  • Electronic structure calculations
  • Structure of solids and liquids

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