Rovibrationally averaged magnetizability, rotational g factor, and indirect spin–spin coupling of the hydrogen fluoride molecule
نویسندگان
چکیده
The magnetizability tensor, the rotational g factor, and the indirect nuclear spin–spin coupling constant of the hydrogen fluoride molecule have been calculated using large multiconfigurational self-consistent field wave functions and large basis sets. For a critical comparison with experiment, rovibrational corrections have also been calculated. For the magnetizability tensor and the spin–spin coupling constant, we present results with higher precision than available experimental data; for the rotational g factor, our results are in good agreement with experiment. © 1999 American Institute of Physics. @S0021-9606~99!02519-2#
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تاریخ انتشار 1999