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- W1992598982 abstract "Abstract The magnetic susceptibility and screening constant tensors are calculated using an ab initio finite perturbation SCF method, with gauge invariant Gaussian orbitals. The isoelectronic BH BeH − , and CH + molecules have been studied. The calculated values for BH are relatively different from those obtained by other methods. The CH + molecule seems to exhibit a stronger temperature independent paramagnetism than BH, while the BeH − molecule would be diamagnetic. The screening constants of the heavy atom of these molecules present a similar variation." @default.
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- W1992598982 date "1983-02-01" @default.
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- W1992598982 title "Ab initio calculation of magnetic susceptibilities and screening constants using gauge invariant Gaussian orbitals" @default.
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- W1992598982 doi "https://doi.org/10.1002/qua.560230204" @default.
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