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• W1628287856 abstract "The multireference configuration interaction (MRCI) method, based on complete-active-space self-consistent-field wave functions, has been employed to study the X1Σ+ and A1Π states of NiC. Potential energy curves, dipole moments, and transition dipole moment functions (TDM) have been computed over a wide range of internuclear separations. Based on these results, the Franck–Condon factors and radiative lifetimes for several vibrational levels of the A1Π state were computed." @default.
• W1628287856 created "2016-06-24" @default.
• W1628287856 creator A5007759201 @default.
• W1628287856 date "2001-12-01" @default.
• W1628287856 modified "2023-09-25" @default.
• W1628287856 title "The transition in NiC" @default.
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• W1628287856 doi "https://doi.org/10.1016/s0301-0104(01)00543-2" @default.
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