The nature of the interaction of organoselenium molecules with diiodine

Journal of Physical Chemistry A

Volumn 115, Issue 35, 2011, Pages 10069-10077

  Madzhidov, Timur I ^a   Chmutova, Galina A ^a   Martín Pendás, Ángel ^b  

^a KAZAN FEDERAL UNIVERSITY   (Russian Federation)

^b UNIVERSITY OF OVIEDO   (Spain)

Author keywords

[No Author keywords available]

Indexed keywords

ATOMIC CHARGE; BASIS SET SUPERPOSITION ERRORS; CHARGE TRANSFER COMPLEX; COMPLEXATION ENERGY; ELECTRON ACCEPTOR; ELECTRON DONORS; EXCHANGE-CORRELATIONS; HARTREE-FOCK; INTERMOLECULAR BONDS; IODINE ATOMS; LAPLACIAN DISTRIBUTION; NITROGEN ATOM; OPTIMIZED GEOMETRIES; ORGANOSELENIUM; ORGANOSELENIUM COMPOUNDS; QUANTUM ATOMS; QUANTUM MECHANICAL; SECOND ORDERS; TOPOLOGICAL CHARGES; VALENCE ANGLES;

ATOMS; CHARGE TRANSFER; DENSITY FUNCTIONAL THEORY; ELECTRONIC STRUCTURE; IODINE; ION EXCHANGE; QUANTUM THEORY; SELENIUM COMPOUNDS; TOPOLOGY;

COMPLEXATION;

EID: 80052319559     PISSN: 10895639     EISSN: 15205215     Source Type: Journal    
DOI: 10.1021/jp2056078     Document Type: Article

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