On Jan 12, 2012, at 5:58 , WF wrote: > I cannot complete all-electron calculation of C with configuration > "[He] 2s2 2p3"
negative ions are not bound in DFT P. --- Paolo Giannozzi, Dept of Chemistry&Physics&Environment, Univ. Udine, via delle Scienze 208, 33100 Udine, Italy Phone +39-0432-558216, fax +39-0432-558222
