Hydrogen bond and halogen bond inside the carbon nanotube

Journal of Chemical Physics

Volumn 134, Issue 5, 2011, Pages

  Wang, Weizhou ^a   Wang, Donglai ^b   Zhang, Yu ^a   Ji, Baoming ^a   Tian, Anmin ^c  

^a LUOYANG NORMAL UNIVERSITY   (China)

^b ANSHAN NORMAL UNIVERSITY   (China)

^c SICHUAN UNIVERSITY   (China)

Author keywords

[No Author keywords available]

Indexed keywords

ANTIBONDING ORBITAL; BASIS SETS; BLUE SHIFTING HYDROGEN BONDS; DENSITY FUNCTIONALS; DRIVING FORCES; ELECTRON-RICH; GASPHASE; HALOGEN ATOMS; HALOGEN BONDS; INNER PHASE; MOLECULAR ELECTROSTATIC POTENTIALS; NATURAL BOND ORBITAL ANALYSIS; POLARIZABLE CONTINUUM MODEL; X-H BOND;

CARBON NANOTUBES; CONTINUUM MECHANICS; DENSITY FUNCTIONAL THEORY; ELECTRIC FIELDS; ELECTRONS; HALOGEN ELEMENTS; HYDROGEN BONDS; REACTION KINETICS; SINGLE-WALLED CARBON NANOTUBES (SWCN);

HYDROGEN;

EID: 79951542492     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3549572     Document Type: Article

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