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Electronic, optical and spectroscopic properties of N-dialkyl-imidazolium hexafluorophosphate (CNMIM.PF6) ionic liquid crystal molecules investigated by computational methods

Varsha Gautam, Mirtunjai Mishra, Khem B. Thapa, Jitendra Kumar, Devendra Singh, Devesh Kumar

2023Journal of Molecular Modeling14 citationsDOI

Topics & Concepts

Ionic liquidHexafluorophosphateBand gapLiquid crystalIonic bondingMoleculeAlkylChemical physicsMaterials scienceCrystal (programming language)ChemistryPhysical chemistryIonCrystallographyOrganic chemistryOptoelectronicsComputer scienceCatalysisProgramming languageNonlinear Optical Materials ResearchLiquid Crystal Research AdvancementsIonic liquids properties and applications
Electronic, optical and spectroscopic properties of N-dialkyl-imidazolium hexafluorophosphate (CNMIM.PF6) ionic liquid crystal molecules investigated by computational methods | Litcius