Spin crossover transition of Fe(phen)2(NCS)2: periodic dispersion-corrected density-functional study

Tomáš Bučko, Jürgen Hafner, Sébastien Lebègue, János G. Ángyán
  • Physical Chemistry Chemical Physics, January 2012, Royal Society of Chemistry
  • DOI: 10.1039/c2cp40111h
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