Diatom-diatom interactions: Building potential energy surfaces and effect of intramolecular vibrations

International Journal of Quantum Chemistry

Volumn 111, Issue 2, 2011, Pages 333-341

  Carmona Novillo, Estela ^a   Bartolomei, Massimiliano ^a   Paérez Ríos, Jesús ^a   Campos Martínez, José ^a   Hernández, Marta I ^a  

^a CSIC   (Spain)

Author keywords

anisotropy; intermolecular interactions; oxygen dimer; van der waals molecules; vibrational dependence

Indexed keywords

CENTROSYMMETRIC MOLECULES; COMMONLY USED; COMPLEX SYSTEMS; DEGREES OF FREEDOM; DIFFERENT GEOMETRY; HIGH-LEVEL AB INITIO CALCULATIONS; INTERACTION POTENTIALS; INTERMOLECULAR INTERACTIONS; INTERMOLECULAR POTENTIALS; INTRAMOLECULAR VIBRATION; INTRAMOLECULAR VIBRATIONAL MODES; OXYGEN DIMER; RELATIVE ORIENTATION; RIGID ROTOR; SPHERICAL HARMONICS; VAN DER WAALS MOLECULES; VIBRATIONAL DEPENDENCE;

ANISOTROPY; HARMONIC ANALYSIS; MOLECULES; OXYGEN; POTENTIAL ENERGY; POTENTIAL ENERGY SURFACES; QUANTUM CHEMISTRY; RIGID ROTORS; SURFACE PHENOMENA; VAN DER WAALS FORCES;

VIBRATION ANALYSIS;

EID: 77957736562     PISSN: 00207608     EISSN: 1097461X     Source Type: Journal    
DOI: 10.1002/qua.22680     Document Type: Article

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