A nine-dimensional ab initio global potential energy surface for the H 2O+ + H2 → H3O+ + H reaction

Journal of Chemical Physics

Volumn 140, Issue 22, 2014, Pages

  Li, Anyang ^a   Guo, Hua ^a  

^a UNIVERSITY OF NEW MEXICO   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ATOMS; DEGREES OF FREEDOM (MECHANICS); ISOTOPES; MEAN SQUARE ERROR; POTENTIAL ENERGY SURFACES;

ANALYTICAL EXPRESSIONS; GLOBAL POTENTIAL ENERGY SURFACES; INVARIANT POLYNOMIALS; KINETIC ISOTOPE EFFECTS; LONG RANGE INTERACTIONS; QUASICLASSICAL TRAJECTORIES; ROOT MEAN SQUARE ERRORS; ROTATIONAL DEGREE OF FREEDOM;

QUANTUM CHEMISTRY;

EID: 84902477476     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.4881943     Document Type: Article

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