mirror of https://github.com/abinit/abinit.git
12 lines
811 B
Plaintext
12 lines
811 B
Plaintext
Hartwigsen-Goedecker-Hutter psp for Yb, from PRB58, 3641 (1998)
|
|
70 24 010605 zatom,zion,pspdat
|
|
3 1 3 0 2001 0 pspcod,pspxc,lmax,lloc,mmax,r2well
|
|
0.500000 17.357144 -1.773916 0.000000 0.000000 rloc, c1, c2, c3, c4
|
|
0.402309 2.120771 -4.802990 0.000000 rs, h11s, h22s, h33s
|
|
0.414358 -0.923212 -1.678540 0.000000 rp, h11p, h22p, h33p
|
|
-0.349470 2.074295 -1.814297 k11p, k22p, k33p
|
|
0.444025 -0.889967 0.000000 0.000000 rd, h11d, h22d, h33d
|
|
0.070076 0.000000 0.000000 k11d, k22d, k33d
|
|
0.238298 -29.932854 0.000000 0.000000 rf, h11f, h22f, h33f
|
|
0.025718 0.000000 0.000000 k11f, k22f, k33f
|