The C2H3+O-2 reaction revisited: Is multireference treatment of the wave function really critical? Letter

Mebel, AM, Kislov, VV. (2005). The C2H3+O-2 reaction revisited: Is multireference treatment of the wave function really critical? . JOURNAL OF PHYSICAL CHEMISTRY A, 109(32), 6993-6997. 10.1021/jp052772t

International Collaboration

keywords

  • AB-INITIO
  • BASIS-SET
  • COMPUTATION
  • COUPLED-CLUSTER ENERGIES
  • Chemistry
  • Chemistry, Physical
  • GAUSSIAN-2
  • GEOMETRIES
  • KINETICS
  • MOLECULAR-OXYGEN
  • Physical Sciences
  • Physics
  • Physics, Atomic, Molecular & Chemical
  • Science & Technology
  • THERMOCHEMISTRY
  • VINYL RADICALS

Digital Object Identifier (DOI)

publisher

  • AMER CHEMICAL SOC

start page

  • 6993

end page

  • 6997

volume

  • 109

issue

  • 32