1991•Journal of Molecular Structure THEOCHEMRequires access

MRSD-CI calculations of deuteron quadrupole coupling constants for low-lying rovibrational levels of HD and D2 in their X1Σg+ and B1Σg+ states

Jan Vojtík, L. Češpiva, Ivana Paidarová, J. Šavrda

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Key concepts: Rotational–vibrational spectroscopy, Quadrupole, Deuterium, Coupling constant, Atomic physics, Chemistry, Ab initio, Coupling (piping)

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MRSD-CI calculations of deuteron quadrupole coupling constants for low-lying rovibrational levels of HD and D2 in their X1Σg+ and B1Σg+ states — Research Paper | ScholarLens