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Fe-q16-pbe.abinit.hgh
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Fe-q16-pbe.abinit.hgh
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Goedecker pseudopotential for Fe
26 16 070301 zatom,zion,pspdat
10 11 2 2 2001 0 pspcod,pspxc,lmax,lloc,mmax,r2well
0.36000000 2 6.75678916 -0.22883251 rloc nloc c1 c2
3 nnonloc
0.27826303 2 0.62950570 7.91313242 rs ns hs11 hs12
-10.21581002 hs22
0.25138338 2 -7.93213293 7.69707888 rp np hp11 hp12
-9.10730654 hp22
0.09786820 0.08070002 kp11 kp12
-0.09548555 kp22
0.22285578 1 -12.38579937 rd nd hd11
0.01036288 kd11