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Cambridge QMC library

Rhenium pseudopotential files

Fig. Description Representation CASINO
awfn.data
Further
data
1 Dirac-Fock
AREP
Trail & Needs
summary
Tabulated ¤ 5d56s2 6S (GS)
¤ 5d66s1 6D
¤ 5d7 4F
¤ 5d66p1 6F
-
2 Dirac-Fock
AREP
Trail & Needs
summary
GAUSSIAN
CRYSTAL
-
Spin-Orbit
Pseudopotential
3 Dirac-Fock
AREP
Trail & Needs
summary
GAMESS
-
-
4 Softer DF
AREP
Trail & Needs
summary
Tabulated
¤ 5d56s2 6S (GS)
¤ 5d66s1 6D
¤ 5d7 4F
¤ 5d66p1 6F
-

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