Coupled calculation of vibrational frequencies and intensities by means of semiempirical quantum chemical methods
Author:
Publisher
Elsevier BV
Subject
Physical and Theoretical Chemistry,Condensed Matter Physics,Biochemistry
Reference49 articles.
1. Ground states of molecules. 37. MINDO/3 calculations of molecular vibration frequencies
2. Semiempirical calculations of molecular vibrational frequencies: The MNDO method
3. Systematic ab initio gradient calculation of molecular geometries, force constants, and dipole moment derivatives
4. Ab initio computation of force constants. The second and third period hydrides
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1. MNDO-Studie zur Struktur und zum Schwingungsspektrum von SiO, Si2O2 und Si3O3;Zeitschrift für Chemie;2010-08-31
2. Electronic Substituent Effects in Molecular Spectroscopy;Progress in Physical Organic Chemistry;2007-04-04
3. Intensities of IR bands of CH stretching vibrations and atomic charges in saturated three-membered rings;Chemistry of Heterocyclic Compounds;1989-12
4. Calculation of vibrational frequencies of (CF3)2CX2 (X H, D, F, Cl);Journal of Molecular Structure: THEOCHEM;1988-06
5. Calculation of the vibrational spectra of cytosine derivatives by the CNDO/2 force method;Journal of Molecular Structure;1988-02
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