Communication: An accurate full 15 dimensional permutationally invariant potential energy surface for the OH + CH4 → H2O + CH3 reaction

Journal of Chemical Physics

Volumn 143, Issue 22, 2015, Pages

  Li, Jun ^a   Guo, Hua ^b  

^a CHONGQING UNIVERSITY   (China)

^b UNIVERSITY OF NEW MEXICO   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

MOLECULAR PHYSICS; NUMERICAL METHODS; POTENTIAL ENERGY SURFACES; QUANTUM CHEMISTRY;

CORRELATION CONSISTENT POLARIZED VALENCE; COUPLED-CLUSTER SINGLES; DYNAMICAL CALCULATIONS; HARMONIC FREQUENCY; INVARIANT POLYNOMIALS; PERMUTATIONALLY INVARIANT; ROOT MEAN SQUARE; STATIONARY POINTS;

POTENTIAL ENERGY;

EID: 84949668394     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.4937570     Document Type: Article

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