Methanol clusters (CH3OH)n, n 3-6 in external electric fields: Density functional theory approach

Journal of Chemical Physics

Volumn 135, Issue 2, 2011, Pages

  Rai, Dhurba ^a,c   Kulkarni, Anant D ^a,b   Gejji, Shridhar P ^a   Pathak, Rajeev K ^a  

^a UNIVERSITY OF PUNE   (India)

^b UNIVERSITY OF MINNESOTA   (United States)

^c TEL AVIV UNIVERSITY   (Israel)

Author keywords

[No Author keywords available]

Indexed keywords

APPLIED FIELD; BLUE SHIFT; BLUESHIFTS; BRANCHED STRUCTURES; C-O STRETCH; EXTERNAL ELECTRIC FIELD; FIELD STRENGTHS; H-BONDED; INTERMOLECULAR HYDROGEN BONDS; LOWER ENERGIES; METHANOL CLUSTERS; RED SHIFT; RING STRUCTURES; STATIC ELECTRIC FIELDS; STRUCTURAL EVOLUTION; STRUCTURAL TRANSITIONS; THRESHOLD FIELDS; WATER CLUSTER;

ELECTRIC DIPOLE MOMENTS; ELECTRIC FIELDS; HYDROGEN; HYDROGEN BONDS; METHANOL; VIBRATION ANALYSIS;

DENSITY FUNCTIONAL THEORY;

EID: 79960522524     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3605630     Document Type: Article

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