• Media type: E-Article
  • Title: Density functional prediction of non cubic isomers of cubane and nitrated cubanes
  • Contributor: Owens, Frank J.
  • imprint: Springer Science and Business Media LLC, 2020
  • Published in: Journal of Molecular Modeling
  • Language: English
  • DOI: 10.1007/s00894-020-04376-7
  • ISSN: 1610-2940; 0948-5023
  • Keywords: Computational Theory and Mathematics ; Inorganic Chemistry ; Organic Chemistry ; Physical and Theoretical Chemistry ; Computer Science Applications ; Catalysis
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