Time-dependent wave packet and quasiclassical trajectory study of the C (P3) +OH (X Π2) →cO (X 1 +) +H (S2) reaction at the state-to-state level

Journal of Chemical Physics

Volumn 130, Issue 19, 2009, Pages

  Bulut, Niyazi ^a   Zanchet, Alexandre ^b,e   Honvault, Pascal ^c   Bussery Honvault, B́atrice ^c   Baares, Luis ^d  

^a FIRAT UNIVERSITY   (Turkey)

^b UNIVERSITÉ DE RENNES 1   (France)

^c Faculté des Sciences et des Techniques La Bouloie   (France)

^d UNIVERSIDAD COMPLUTENSE DE MADRID   (Spain)

^e INSTITUTO DE FÍSICA FUNDAMENTAL   (Spain)

Author keywords

[No Author keywords available]

Indexed keywords

AB INITIO POTENTIAL ENERGY SURFACE; COLLISION ENERGIES; INTEGRAL CROSS-SECTION; QUASICLASSICAL TRAJECTORIES; RATE COEFFICIENTS; REACTION PROBABILITY; ROTATIONAL EXCITATION; ROVIBRATIONAL STATE; STATE REACTION; TIME-DEPENDENT WAVE PACKETS; WAVE PACKET CALCULATION;

POTENTIAL ENERGY; POTENTIAL ENERGY SURFACES; QUANTUM CHEMISTRY; WAVE PACKETS; WAVES;

PROBABILITY;

EID: 65949091586     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3125956     Document Type: Article

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