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From Molecules to Materials: Engineering New Ionic Liquid Crystals Through Halogen Bonding
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Gas-phase electronic properties of tri-cationic imidazolium-based ionic liquids in comparison with mono- and

Azim Soltanabadi1, Maryam Bahrami2

  • 1Department of Physical Chemistry, Faculty of Chemistry, Razi University, Kermanshahm, Iran.

Journal of Molecular Graphics & Modelling
|January 10, 2020
PubMed

Keywords:
Charge densityDFTDipole momentHOMO-LUMO energy gapInteraction energyMono-cationicNBO analysisNon-linear trigeminal tri-cationic ILsdi-cationic

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