Competition between nonclassical hydrogen-bonded acceptor sites in complexes of neutral AH2 radicals (A = B, Al, and Ga): A theoretical investigation

Journal of Physical Chemistry A

Volumn 110, Issue 37, 2006, Pages 10817-10821

  Solimannejad, Mohammad ^a   Alkorta, Ibon ^b  

^a ARAK UNIVERSITY   (Iran)

^b INSTITUTO DE QUÍMICA MÉDICA   (Spain)

Author keywords

[No Author keywords available]

Indexed keywords

AB INITIO COMPUTATIONAL STUDY; DIHYDROGEN BONDS; SINGLE-ELECTRON HYDROGEN-BONDED (SEHB) COMPLEXES;

BINDING ENERGY; COMPLEXATION; DIMERS; HYDROGEN BONDS;

FREE RADICALS;

ALUMINUM; BORON; GALLIUM;

ARTICLE; CHEMICAL MODEL; CHEMISTRY; COMPUTER SIMULATION; HYDROGEN BOND; QUANTUM THEORY; THERMODYNAMICS;

ALUMINUM; BORON; COMPUTER SIMULATION; GALLIUM; HYDROGEN BONDING; MODELS, CHEMICAL; QUANTUM THEORY; THERMODYNAMICS;

EID: 33749631219     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp062620d     Document Type: Article

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