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Publication DateTitleAuthor(s)
6-Apr-2020Molecular mechanism for azeotrope formation in ethanol/benzene binary mixtures through Gibbs ensemble Monte Carlo simulationLi, Dongyang; Gao, Ziqi; Vasudevan, Naveen Kumar; Li, Hong; Gao, Xin; Li, Xingang; Xi, Li
2017Effects of precursor topology on polymer networks simulated with molecular dynamicsZhang, Shimiao; Xi, Li
2018An atomistic evaluation of the compatibility and plasticization efficacy of phthalates in poly(vinyl chloride)Li, Dongyang; Panchal, Kushal; Mafi, Roozbeh; Xi, Li
2019Molecular simulation for predicting the rheological properties of polymer meltsXi, Li

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Author
  • 4 Xi, Li
  • 2 Li, Dongyang
  • 1 Gao, Xin
  • 1 Gao, Ziqi
  • 1 Li, Hong
  • 1 Li, Xingang
  • 1 Mafi, Roozbeh
  • 1 Panchal, Kushal
  • 1 Vasudevan, Naveen Kumar
  • 1 Zhang, Shimiao
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Subject
  • 1 Additives
  • 1 Azeotrope
  • 1 Crosslinked Polymers
  • 1 Crosslinking Kinetics
  • 1 Hydrogen Bonds
  • 1 Marte Carlo Simulation
  • 1 Materials Properties
  • 1 Mixture Thermodynamics
  • 1 Molecular Dynamics
  • 1 Multiscale Modeling
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Date issued
  • 1 2020
  • 1 2019
  • 1 2018
  • 1 2017
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