Nature of a hydride-halogen bond. A SAPT-, QTAIM-, and NBO-based study

Journal of Physical Chemistry A

Volumn 116, Issue 9, 2012, Pages 2322-2332

  Jabłoński, Mirosław ^a   Palusiak, Marcin ^b  

^a NICOLAUS COPERNICUS UNIVERSITY   (Poland)

^b UNIVERSITY OF LODZ   (Poland)

Author keywords

[No Author keywords available]

Indexed keywords

BLUE SHIFT; BONDED SYSTEMS; BONDING ORBITALS; INTERACTION ENERGIES; IR INTENSITIES; NATURAL BOND ORBITAL; QUANTUM THEORY OF ATOMS IN MOLECULES; QUANTUM-MECHANICAL CALCULATION; STRETCHING VIBRATIONS; SYMMETRY ADAPTED PERTURBATION THEORY;

BROMINE; CHARGE TRANSFER; CHLORINE COMPOUNDS; FLUORINE; HYDRIDES; HYDROGEN BONDS; IODINE; QUANTUM COMPUTERS; QUANTUM THEORY; STRETCHING;

CHLORINE;

EID: 84858060284     PISSN: 10895639     EISSN: 15205215     Source Type: Journal    
DOI: 10.1021/jp211606t     Document Type: Article

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