Coupled-cluster study of the rotational and inversion barrier heights, equilibrium geometries and vibrational frequencies of methylamine

Chemical Physics Letters

Volumn 414, Issue 4-6, 2005, Pages 495-499

  Pelegrini, Marina ^a   Roberto Neto, Orlando ^b   Machado, Francisco B C ^a  

^a INSTITUTO TECNOLÓGICO DE AERONÁUTICA   (Brazil)

^b INSTITUTO DE ESTUDOS AVANÇADOS   (Brazil)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTATIONAL GEOMETRY; CORRELATION METHODS; ELECTRON DIFFRACTION; ELECTRON ENERGY LEVELS; MICROWAVES; MOLECULAR DYNAMICS; MOLECULAR VIBRATIONS; ROTATION;

COUPLED-CLUSTER STUDY; INTERNAL ROTATION; INVERSION BARRIER HEIGHTS; INVERSION MOTION; METHYLAMINE;

AMINES;

EID: 25844520491     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2005.08.127     Document Type: Article

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