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Analyzing Melts and Fluids from Ab Initio Molecular Dynamics Simulations with the UMD Package
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Hydrogen bonding and van der Waals forces contributions to the melting enthalpy: insights from volumetric and

Andrey A Sokolov1, Boris N Solomonov1, Mikhail I Yagofarov1

  • 1Department of Physical Chemistry, Kazan Federal University, Kremlevskaya str. 18, 420008 Kazan, Russia. AndASokolov@kpfu.ru.

Physical Chemistry Chemical Physics : PCCP
|October 8, 2025
PubMed

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