Ta Pseudopotentials

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Cambridge QMC library

Tantalum pseudopotential files

Fig.	Description	Representation	CASINO awfn.data	Further data
1	Dirac-Fock AREP Trail & Needs summary	Tabulated	¤ 5d³6s² 4F (GS) ¤ 5d⁴6s¹ 6D ¤ 5d⁵ 6S ¤ 5d⁴6p¹ 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	¤ 5d³6s² 4F (GS) ¤ 5d⁴6s¹ 6D ¤ 5d⁵ 6S ¤ 5d⁴6p¹ 6F	-

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