Theoretical Study of the Acetonitrile Reaction with the Methine Radical Article

Krikunova, LI, Kuznetsova, AA, Porfiriev, DP et al. (2024). Theoretical Study of the Acetonitrile Reaction with the Methine Radical . COMBUSTION EXPLOSION AND SHOCK WAVES, 60(4), 445-449. 10.1134/S001050822404004X

International Collaboration

cited authors

  • Krikunova, LI; Kuznetsova, AA; Porfiriev, DP; Azyazov, VN; Mebel, AM

authors

publication date

  • August 1, 2024

published in

keywords

  • Energy & Fuels
  • Engineering
  • Engineering, Chemical
  • Engineering, Multidisciplinary
  • IDENTIFICATION
  • Materials Science
  • Materials Science, Multidisciplinary
  • Physical Sciences
  • Science & Technology
  • Technology
  • Thermodynamics
  • acetonitrile
  • coupled cluster method
  • density functional theory
  • methine radical
  • nitriles
  • potential energy surface
  • quantum chemistry

Digital Object Identifier (DOI)

publisher

  • MAIK NAUKA/INTERPERIODICA/SPRINGER

start page

  • 445

end page

  • 449

volume

  • 60

issue

  • 4