We used the internally contracted explicitly correlated multireference configuration interaction (icMRCI-F12) method combined with Davidson correction to conduct a high-precision ab initio study of CHBr. The 21 electronic states of... Click to show full abstract
We used the internally contracted explicitly correlated multireference configuration interaction (icMRCI-F12) method combined with Davidson correction to conduct a high-precision ab initio study of CHBr. The 21 electronic states of...
               
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