First quantum mechanical computations of collision-induced absorption spectra of H2 pairs in the second overtone band

Computer Science

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Vibration-Rotation Analysis, Infrared Spectra, Electronic Excitation And Ionization Of Molecules, Intermediate Molecular States, Ab Initio Calculations

Scientific paper

The rotovibrational collision-induced absorption (CIA) spectra of H2-H2
pairs in the second overtone band (Δv=3), which is very important
in the studies of the stellar and the planetary atmospheres, are
computed for the first time from the ab initio induced-dipole moments.

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