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- W1964550393 abstract "A b initio relativistic calculations have been performed for the two lowest electronic states of the PtH molecule, with relativistic effects accounted for by means of relativistic core potentials and first-order perturbation theory. Electron correlation has been treated at the multireference configuration interaction level. The 2Σ and 2Δ states are close in energy, with the Σ state somewhat lower, according to the core potential calculations. It is concluded that a method which gives a correct atomic description is imperative to describe the spectroscopy of the molecule." @default.
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- W1964550393 date "1992-06-01" @default.
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- W1964550393 title "Relativistic calculations on platinum hydride using effective core potentials and first-order perturbation theory" @default.
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- W1964550393 doi "https://doi.org/10.1063/1.462289" @default.
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