Ab initio study of the reaction mechanism of CO2 with Ti atom in the ground and excited electronic states Article

Hwang, DY, Mebel, AM. (2002). Ab initio study of the reaction mechanism of CO2 with Ti atom in the ground and excited electronic states . JOURNAL OF CHEMICAL PHYSICS, 116(13), 5633-5642. 10.1063/1.1453954

cited authors

  • Hwang, DY; Mebel, AM

authors

publication date

  • April 1, 2002

published in

keywords

  • CARBON-DIOXIDE ACTIVATION
  • COMPLEXES
  • CONFIGURATION-INTERACTION
  • COORDINATION
  • Chemistry
  • Chemistry, Physical
  • INFRARED-SPECTRA
  • MATRIX-ISOLATION
  • METAL ATOMS
  • MODEL
  • MONOXIDE
  • NICKEL ATOMS
  • Physical Sciences
  • Physics
  • Physics, Atomic, Molecular & Chemical
  • Science & Technology

Digital Object Identifier (DOI)

publisher

  • AIP Publishing

start page

  • 5633

end page

  • 5642

volume

  • 116

issue

  • 13