Reaction mechanism and rate constants of the CH+CH4 reaction: a theoretical study Article

Ribeiro, Joao Marcelo, Mebel, Alexander M. (2015). Reaction mechanism and rate constants of the CH+CH4 reaction: a theoretical study . MOLECULAR PHYSICS, 113(13-14), 1865-1872. 10.1080/00268976.2015.1019584

cited authors

  • Ribeiro, Joao Marcelo; Mebel, Alexander M

sustainable development goals

authors

publication date

  • July 18, 2015

published in

keywords

  • AB-INITIO
  • BASIS-SETS
  • CH insertion
  • CH4
  • CORRELATION-ENERGY
  • Chemistry
  • Chemistry, Physical
  • DENSITY
  • HYDROGEN
  • IMPLEMENTATION
  • PERTURBATION-THEORY
  • Physical Sciences
  • Physics
  • Physics, Atomic, Molecular & Chemical
  • Science & Technology
  • ab initio calculations
  • potential energy surface of the CH+CH4 reaction
  • rate constant
  • transition state theory

Digital Object Identifier (DOI)

publisher

  • TAYLOR & FRANCIS LTD

start page

  • 1865

end page

  • 1872

volume

  • 113

issue

  • 13-14