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- W51401513 abstract "This paper deals with the least-squares determination of effective rotational constants for the lowest three vibrational states of the ketene (CH2CO) molecule:v 5,v 6 andv 9. Several hundred rotational lines have been assigned in high-resolution Fourier-transform infrared spectra and were fitted to a standard, Watson Hamiltonian in theA-reduction formalism. The effectiveA rotational constants were used to extract vibration-rotation interaction α values and these values are compared to those obtained from a perturbation formula and to values from highly accurate quantum-chemical calculations in the literature. The results show the strong effects ofa-type Coriolis interactions among the modes involved, and prepare the way for full numerical diagonalization-type determination of the vibration-rotation constants." @default.
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- W51401513 date "1994-09-01" @default.
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- W51401513 title "Effective rotational constants for the three lowest vibrational states of ketene" @default.
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- W51401513 doi "https://doi.org/10.1007/bf03156409" @default.
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