Using ab initio MO calculations to understand the photodissociation dynamics of CH2CCH2 and CH2C2 Article

Jackson, WM, Mebel, AM, Lin, SH et al. (1997). Using ab initio MO calculations to understand the photodissociation dynamics of CH2CCH2 and CH2C2 . JOURNAL OF PHYSICAL CHEMISTRY A, 101(36), 6638-6646. 10.1021/jp970597d

International Collaboration

cited authors

  • Jackson, WM; Mebel, AM; Lin, SH; Lee, YT

sustainable development goals

authors

publication date

  • September 4, 1997

published in

keywords

  • C3H4 SURFACE
  • COUPLED-CLUSTER SINGLES
  • Chemistry
  • Chemistry, Physical
  • DENSITY-FUNCTIONAL THERMOCHEMISTRY
  • EXCITED-STATES
  • FRANCK-CONDON FACTORS
  • GROUND-STATE
  • INTERNAL-ROTATION
  • MOLECULAR-ORBITAL THEORY
  • POTENTIAL-ENERGY SURFACE
  • Physical Sciences
  • Physics
  • Physics, Atomic, Molecular & Chemical
  • QUADRATIC CONFIGURATION-INTERACTION
  • Science & Technology

Digital Object Identifier (DOI)

publisher

  • AMER CHEMICAL SOC

start page

  • 6638

end page

  • 6646

volume

  • 101

issue

  • 36