Back to Search
Start Over
Multiple solutions of inverse vibrational problems from the parametric approach to two-dimensional species
- Source :
- Journal of Molecular Structure. 291:123-133
- Publication Year :
- 1993
- Publisher :
- Elsevier BV, 1993.
-
Abstract
- The non-iterative parametric approach to solving two-dimensional inverse vibrational problems is discussed with respect to the search for all multiple solutions. Symmetry force constants for acetylene, ethylene, methane, silane, germane, stannane and their deuterium isotopes, for carbon-12 and carbon-13 isotopes of tetrafluoromethane, as well as for ammonia, phosphine, arsine, stibine and their deuterium isotopes, are determined with high accuracy. Good agreement with force fields cited from other authors is observed. The results for the two-dimensional symmetry species of acetylene and ethylene are compared with results of the iterative method of isotopic molecular force constant invariance (B. Nikolova, Commun. Dep. Chem., Bulg. Acad. Sci., 21/2 (1988) 158).
- Subjects :
- Stibine
Organic Chemistry
Born–Oppenheimer approximation
Molecular physics
Stannane
Analytical Chemistry
Inorganic Chemistry
symbols.namesake
chemistry.chemical_compound
chemistry
Deuterium
Acetylene
Computational chemistry
Germane
Kinetic isotope effect
symbols
Tetrafluoromethane
Physics::Chemical Physics
Spectroscopy
Subjects
Details
- ISSN :
- 00222860
- Volume :
- 291
- Database :
- OpenAIRE
- Journal :
- Journal of Molecular Structure
- Accession number :
- edsair.doi...........c3ed23d3e34f6df3b99eb99265110ba9
- Full Text :
- https://doi.org/10.1016/0022-2860(93)80257-v