The combined use of SCF-MO calculations and experimental data in the evaluation of quadratic force fields
Author:
Publisher
Elsevier BV
Subject
Physical and Theoretical Chemistry,Spectroscopy,Atomic and Molecular Physics, and Optics
Reference26 articles.
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1. The Characterization of Metal–Metal Bonds in Unsaturated Binuclear Homoleptic Transition Metal Carbonyls. The Compliance Matrix;Zeitschrift für Physikalische Chemie;2003-03-01
2. Calculation of the vibrational force field for 4-nitropyridine N-oxide by the AM1 and MNDO semi-empirical methods;Spectrochimica Acta Part A: Molecular Spectroscopy;1989-01
3. The use of CNDO/force and compliance constant methods in evaluating quadratic potential functions of carbonyl and formyl fluorides;Journal of Computational Chemistry;1983
4. Ab initio and semiempirical studies of the equilibrium geometry and in-plane vibrational spectra of tetracyanoethylene and the tricyanovinyl alcoholate anion;The Journal of Physical Chemistry;1982-10
5. Determination of force fields for formaldehyde, acetaldehyde and acetone by the CNDO/force method;Journal of Molecular Structure: THEOCHEM;1982-04
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