Institute for Theoretical Chemistry, University of Cologne |
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Pseudopotentials, ECPs |
Basis set ECP28SDF for Zn, ECP28SDF! (3s3p1d)/[3s3p1d]-Basissatz fuer PP. von Ref A5. s,Zn,0.717675,0.203735,0.060278; p,Zn,1.244121,0.172988,0.049865; d,Zn,0.460000; ! References: ! Unpublished: ! [A5] G. Igel-Mann, Doktorarbeit (1987) |
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