Theoretical study of Si+(2PJ)-RG complexes and transport of Si+(2PJ) in RG (RG = He – Ar)
We calculate accurate interatomic potentials for the interaction of a singly-charged silicon cation with a rare gas atom of helium, neon or argon. We employ the RCCSD(T) method, and basis sets of quadruple- and quintuple- quality; each point is counterpoise corrected and extrapolated to the basis s...
| Main Authors: | , , , |
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| Format: | Article |
| Published: |
Taylor & Francis
2017
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| Online Access: | https://eprints.nottingham.ac.uk/39032/ |