Please use this identifier to cite or link to this item: http://dspace.iitrpr.ac.in:8080/xmlui/handle/123456789/350
Title: Ultracold rotational deexcitation of CO (1Σ+) collision with proton
Authors: Kaur, R.
Kumar, T.J.D.
Keywords: Ground state
Molecular physics
Potential energy surfaces
Quantum chemistry
Ab initio potential energy surface
Close-coupling method
Collision energies
Ground state potential
Multipolar expansion
Rate coefficients
Rotational quenching
Ultracold collisions
Potential energy
Issue Date: 16-Nov-2016
Abstract: Ultracold rotational deexcitation cross sections and rate coefficients have been computed for CO collision with proton using close-coupling method on the two-dimensional ground state potential energy surface computed at the MRCI/cc-pVTZ level of theory. State-to-state rate coefficients have been obtained for temperature range from 10 5 K to 200 K. The system displays higher propensity with j 0 = 0 cross section magnitude closer to j 0 = 1 state, and j 0 = 2 cross section closer to j 0 = 3 state, from initial j = 4 state. In ultracold region, the magnitude of cross section increases with the decrease in collision energy following Wigner’s threshold law.
URI: http://localhost:8080/xmlui/handle/123456789/350
Appears in Collections:Year-2016

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