Ge Pseudopotentials

line

Cambridge QMC library

Germanium pseudopotential files

Fig.	Description	Representation	CASINO awfn.data	Further data
1	Dirac-Fock AREP Trail & Needs summary	Tabulated	¤ 4s²4p² 3P (GS) ¤ 4s¹4p³ 5S ¤ 4s²4p¹4d¹ 3F	Core-Polarization
2	Dirac-Fock AREP Trail & Needs summary	GAUSSIAN CRYSTAL	-	Spin-Orbit Pseudopotential
3	Dirac-Fock AREP Trail & Needs summary	GAMESS	-	-
4	Hartree-Fock Trail & Needs summary	Tabulated	¤ 4s²4p² 3P (GS) ¤ 4s¹4p³ 5S ¤ 4s²4p¹4d¹ 3F	Core-Polarization
5	Hartree-Fock Trail & Needs summary	GAUSSIAN CRYSTAL	-	-
6	Hartree-Fock Trail & Needs summary	GAMESS	-	-
7	Softer DF AREP Trail & Needs summary	Tabulated	¤ 4s²4p² 3P (GS) ¤ 4s¹4p³ 5S ¤ 4s²4p¹4d¹ 3F	Core-Polarization

line