Molecular Dynamics Simulations and Product Vibrational Spectral Analysis for the Reactions of NO2 with 1-Ethyl-3-methylimidazolium Dicyanamide (EMIM+DCA–), 1-Butyl-3-methylimidazolium Dicyanamide (BMIM+DCA–), and 1-Allyl-3-methylimidazolium Dicyanamide (AMIM+DCA–)

Document Details

Document Type
Pub Defense Publication
Publication Date
May 04, 2020
Source ID
10.1021/acs.jpcb.0c02253

Entities

People

  • Ghanshyam L Vaghjiani
  • Jianbo Liu
  • Steven D Chambreau
  • Wenjing Zhou

Organizations

  • Air Force Office of Scientific Research
  • Air Force Research Laboratory
  • Queens College