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An adaptive distance-based group contribution method for thermodynamic property prediction

2016
期刊 Physical Chemistry Chemical Physics
A new distance-based group contribution method that describes intramolecular interactions systematically is developed to calculate thermodynamic properties accurately and efficiently.

  • 卷 18
  • 期 34
  • 页码 23822-23830
  • Royal Society of Chemistry (RSC)
  • ISSN: 1463-9076
  • DOI: 10.1039/c6cp02929a