Interactions of C+(2PJ) with rare gas atoms: incipient chemical interactions, potentials and transport coefficients

Interactions of C+(2PJ) with rare gas atoms: incipient chemical interactions, potentials and transport coefficients

Accurate interatomic potentials were calculated for the interaction of a singly charged carbon cation, C+, with a single rare gas atom, RG (RG = Ne–Xe). The RCCSD(T) method and basis sets of quadruple-ζ and quintuple-ζ quality were employed; each interaction energy was counterpoise corrected and ext...

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Bibliographic Details
Main Authors: Tuttle, William D., Thorington, Rebecca L., Viehland, Larry A., Breckenridge, W.H., Wright, Timothy G.
Format: Article
Language:English
Published: The Royal Society 2018
Subjects:
carbon cation; rare gas; spectroscopy; bonding; ion transport
Online Access:https://eprints.nottingham.ac.uk/46411/

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