Cross sections and rate constants for OH H2 reaction on three different potential energy surfaces for ro-vibrationally excited reagents

Journal of Chemical Physics

Volumn 135, Issue 19, 2011, Pages

  Bhattacharya, Sayak ^a   Panda, Aditya N ^a   Meyer, Hans Dieter ^b  

^a INDIAN INSTITUTE OF TECHNOLOGY GUWAHATI   (India)

^b UNIVERSITY OF HEIDELBERG   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

APPROXIMATE RESULTS; CORIOLIS COUPLING; COUPLED CHANNELS; CROSS SECTION; INTEGRAL CROSS-SECTIONS; KINETIC-ENERGY OPERATOR; LARGE CROSS-SECTIONS; MULTICONFIGURATION TIME-DEPENDENT HARTREE METHOD; OH REACTION; QUASICLASSICAL TRAJECTORIES; REAGENT ROTATION; SURFACE CHARACTERISTICS; SYSTEMATIC STUDY; TRANSITION STATE STRUCTURE; VIBRATIONAL EXCITATION;

EXCITED STATES; POTENTIAL ENERGY; POTENTIAL ENERGY SURFACES; QUANTUM CHEMISTRY; SURFACE STRUCTURE;

RATE CONSTANTS;

HYDROGEN; HYDROXIDE; HYDROXIDE ION;

ARTICLE; CHEMISTRY; KINETICS; QUANTUM THEORY; SURFACE PROPERTY; VIBRATION;

HYDROGEN; HYDROXIDES; KINETICS; QUANTUM THEORY; SURFACE PROPERTIES; VIBRATION;

EID: 81855228595     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3660222     Document Type: Article

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