mirror of https://github.com/abinit/abinit.git
12 lines
811 B
Plaintext
12 lines
811 B
Plaintext
Hartwigsen-Goedecker-Hutter psp for Rb, from PRB58, 3641 (1998)
|
|
37 1 010605 zatom,zion,pspdat
|
|
3 1 2 0 2001 0 pspcod,pspxc,lmax,lloc,mmax,r2well
|
|
1.096207 0.847333 -0.748120 0.000000 0.000000 rloc, c1, c2, c3, c4
|
|
0.955699 0.887460 0.903088 -0.006750 rs, h11s, h22s, h33s
|
|
1.156681 0.461734 0.336113 0.000000 rp, h11p, h22p, h33p
|
|
-0.043443 0.057876 0.000000 k11p, k22p, k33p
|
|
0.664323 -1.362938 0.000000 0.000000 rd, h11d, h22d, h33d
|
|
0.003708 0.000000 0.000000 k11d, k22d, k33d
|
|
0.000000 0.000000 0.000000 0.000000 rf, h11f, h22f, h33f
|
|
0.000000 0.000000 0.000000 k11f, k22f, k33f
|