Relationship between force constants and bond lengths for CX (X = C, Si, Ge, N, P, As, O, S, Se, F, Cl and Br) single and multiple bonds: Formulation of Badger's rule for universal use

Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy

Volumn 60, Issue 13, 2004, Pages 3013-3023

  Kurita, Eiichi ^a   Matsuura, Hiroatsu ^a   Ohno, Keiichi ^a  

^a HIROSHIMA UNIVERSITY   (Japan)

Author keywords

Badger's rule; Bond lengths; Density functional calculations; Force constants; Group 14 17 compounds

Indexed keywords

CORRELATION METHODS; HARMONIC ANALYSIS; OPTIMIZATION; PERMITTIVITY; POTENTIAL ENERGY; PROBABILITY DENSITY FUNCTION; RAMAN SCATTERING; WAVE EFFECTS;

BADGER'S RULE; BOND LENGTHS; DENSITY FUNCTIONAL CALCULATIONS; FORCE CONSTANTS; GROUP 14-17 COMPOUNDS;

CHEMICAL BONDS;

ELEMENT;

ARTICLE; CHEMICAL MODEL; VIBRATION;

ELEMENTS; MODELS, CHEMICAL; VIBRATION;

EID: 5444258109     PISSN: 13861425     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.saa.2004.02.015     Document Type: Article

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