Comprehensive study of density functional theory based properties for group 14 atoms and functional groups, -XY3 (X = C, Si, Ge, Sn, Pb, Element 114; Y = CH3, H, F, Cl, Br, I, At)

Journal of Physical Chemistry A

Volumn 109, Issue 12, 2005, Pages 2925-2936

  Giju, Kalathingal T ^a   De Proft, Frank ^a   Geerlings, Paul ^a  

^a VRIJE UNIVERSITEIT BRUSSEL   (Belgium)

Author keywords

[No Author keywords available]

Indexed keywords

ASTATINE; BROMINE; CARBON; CHLORINE; ELECTRONIC PROPERTIES; FLUORINE; GERMANIUM; HARDNESS; HYDROGEN; IODINE; LEAD; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; SILICON; TIN;

CHEMICAL HARDNESS; ELECTRONEGATIVITY; ELECTROPHILICITY INDEX; FUNCTIONAL GROUPS;

PROBABILITY DENSITY FUNCTION;

EID: 17144377856     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp050463x     Document Type: Article

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