Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
5386185 | Chemical Physics Letters | 2009 | 9 Pages |
Abstract
Size extensive (SC)2-MR-SDCI and LR-CCSDR(3) calculations of vertical excitation energies of HF in the 10-16Â eV spectral region are reported paying attention to the relevance of the Rydberg-valence mixing in this molecular system.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
J. Pitarch-Ruiz, J. Sánchez-MarÃn, C. LavÃn, A.M. Velasco, I. MartÃn,