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Potential energy surfaces and rovibrational line lists of diazophosphane

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Zenodo2023-05-22 更新2026-05-26 收录
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Molpro restart file (ASCII) for the XSURF program of the potential energy and dipole moment surfaces of diazophosphane. Line list (ASCII) for diazophosphane obtained from RVCI calculations. Data refer to the publication "Spectroscopic characterization of diazophosphane - a candidate for interstellar observations" (https://doi.org/10.3847/1538-4357/acc9ad)

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Zenodo
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2023-03-31
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