State of the art theoretical study and comparison to experiment for the phenol ⋯ argon complex

Journal of Chemical Physics

Volumn 128, Issue 11, 2008, Pages

  Černý, Jirí ^a   Tong, Xin ^a   Hobza, Pavel ^a,b   Müller Dethlefs, Klaus ^a  

^a UNIVERSITY OF MANCHESTER   (United Kingdom)

^b INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY   (Czech Republic)

Author keywords

[No Author keywords available]

Indexed keywords

ARGON; COMPUTATIONAL GEOMETRY; CONFORMATIONS; ENTHALPY; ERROR ANALYSIS; IONIZATION; STABILIZATION; VIBRATIONAL SPECTRA;

COMPLETE BASIS SET (CBS); INTERACTION ENERGY; STABILIZATION ENERGY; THEORETICAL STUDY; THRESHOLD IONIZATION SPECTROSCOPY;

PHENOLS;

ARGON; PHENOL DERIVATIVE;

ARTICLE; CHEMICAL MODEL; CHEMISTRY; ENERGY TRANSFER; HYDROGEN BOND; MASS SPECTROMETRY; METABOLISM; QUANTUM THEORY; THEORETICAL MODEL; THERMODYNAMICS;

ARGON; ENERGY TRANSFER; HYDROGEN BONDING; MASS SPECTROMETRY; MODELS, CHEMICAL; MODELS, THEORETICAL; PHENOLS; QUANTUM THEORY; THERMODYNAMICS;

EID: 41049111622     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2838185     Document Type: Article

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