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Isothermal-isobaric algorithm to study the effects of rotational degrees of freedom-Benz water model

Peter Ogrin1, Tomaz Urbic1

  • 1Faculty of Chemistry and Chemical Technology, University of Ljubljana, Vecna Pot 113, SI-1000 Ljubljana, Slovenia.

Journal of Molecular Liquids
|September 20, 2023
PubMed

Keywords:
Isotermal isobaricMonte carlo methodsWater

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