AB initio spin-orbit coupling constants for potential exotic interstellar molecules

Details AB initio spin-orbit coupling constants for potential exotic interstellar molecules AB initio spin-orbit coupling constants for potential exotic interstellar molecules

Feb 1983

adsabs.harvard.edu/cgi-bin/nph-data_query?bibcode=1983apj...265..808c&link_type=abstract

Astrophysical Journal, Part 1, vol. 265, Feb. 15, 1983, p. 808-812. Research supported by the Science and Engineering Research

Other

23

Ground State, Molecular Clouds, Molecular Energy Levels, Molecular Interactions, Molecular Spectra, Spin-Orbit Interactions, Hartree Approximation, Hydrides, Hydrocarbons, Molecular Excitation, Polyatomic Molecules, Silicon Carbides

Scientific paper

Ab initio spin-orbit coupling constants have been computed for the C2, SiC, HCCC, and HCCO molecules. The calculations for C2 are used to assess the accuracy of the other theoretical values. The results for HCCC and HCCO are discussed in terms of the corresponding hydrides, CH and OH, and in terms of previous calculations.

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