Accuracy
re2r
7524 Rhenium, dimer (Geo)
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REF: Estimated from DGauss results of DFT calculations, using the B88-PW91 functional and the DZVP basis set, in CAChe 6.0, Fujitsu Ltd, 2003.
GEO-OK UHF FIELD=(0,0.01,0) PM7
Rhenium, dimer
<Re-Re> GR=PW91D
Re 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
Re 2.03500000 +1 0.0000000 +0 0.0000000 +0 1 0 0