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Abstract
Ämnesord
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- We report full quantum scattering calculations for near-threshold collision cross sections for excitation of Na by H. The calculations include contributions from transitions between all singlet states up to and including the ionic state (ion-pair production). The dynamics calculations are based on three sets of recent ab initio and pseudo-potential quantum-chemical calculations. Considerable sensitivity to the couplings employed is found.
Nyckelord
- Ab initio
- Collision cross sections
- Ion pairs
- Ionic state
- Quantum scattering
- Quantum-chemical calculation
- Singlet state
- Atoms
- Excited states
- Quantum chemistry
- Calculations
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- art (ämneskategori)
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