Three-dimensional Ab initio potential energy surface for H-CO(X̃ 2 A ′)

Journal of Physical Chemistry A

Volumn 117, Issue 32, 2013, Pages 7571-7579

  Song, Lei ^a   Van Der Avoird, Ad ^a   Groenenboom, Gerrit C ^a  

^a RADBOUD UNIVERSITY NIJMEGEN   (Netherlands)

Author keywords

[No Author keywords available]

Indexed keywords

BOND STRENGTH (CHEMICAL); CALCULATIONS; INVERSE PROBLEMS; NUMERICAL METHODS; POTENTIAL ENERGY; QUANTUM CHEMISTRY;

AB INITIO POTENTIAL ENERGY SURFACE; COMPLETE BASIS SET LIMIT; CORRELATION CONSISTENT BASIS SETS; COUPLED-CLUSTER METHODS; DISCRETE VARIABLE REPRESENTATION; DISSOCIATION ENERGIES; LONG RANGE INTERACTIONS; REPRODUCING KERNEL HILBERT SPACES;

BOND LENGTH;

EID: 84882443749     PISSN: 10895639     EISSN: 15205215     Source Type: Journal    
DOI: 10.1021/jp402470b     Document Type: Article

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