The hydrogen peroxide-rare gas systems: Quantum chemical calculations and hyperspherical harmonic representation of the potential energy surface for atom-floppy molecule interactions

Journal of Physical Chemistry A

Volumn 111, Issue 49, 2007, Pages 12754-12762

  Barreto, Patricia R P ^a   Vilela, Alessandra F A ^b   Lombardi, Andrea ^c   Maciel, Glauciete S ^c   Palazzetti, Federico ^c   Aquilanti, Vincenzo ^c  

^a INSTITUTO NACIONAL DE PESQUISAS ESPACIAIS   (Brazil)

^b UNIVERSITY OF BRASILIA   (Brazil)

^c UNIVERSITY OF PERUGIA   (Italy)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTATION THEORY; HYDROGEN PEROXIDE; MOLECULAR INTERACTIONS; POTENTIAL ENERGY;

MOLECULAR DYNAMICS SIMULATIONS; RARE GAS SYSTEMS;

QUANTUM CHEMISTRY;

EID: 38049169460     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp076268v     Document Type: Article

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