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physics.chem-ph2012★ 13 cited
Ab initio potential curves for the X , A and B states of Ca
Sandipan Banerjee, John A. Montgomery, Jason N. Byrd +2
We report \textit{ab initio} calculations of the X , A and B states of the Ca dimer. All electron CAS+MRCI calculations are performed for t…
physics.chem-ph2010
Ab initio potential curves for the X and B states of Be: Existence of a double minimum
Sandipan Banerjee, Jason N. Byrd, Robin Côté +2
We report ab initio calculations of the X and B states of the Be dimer. Full valence configuration interaction calculations were performed using…