mirror of https://github.com/abinit/abinit.git
10 lines
503 B
Plaintext
10 lines
503 B
Plaintext
Hartwigsen-Goedecker-Hutter psp for Na, from PRB58, 3641 (1998)
|
|
11 1 010605 zatom,zion,pspdat
|
|
3 1 1 0 2001 0 pspcod,pspxc,lmax,lloc,mmax,r2well
|
|
0.885509 -1.238867 0.000000 0.000000 0.000000 rloc, c1, c2, c3, c4
|
|
0.661104 1.847271 0.582004 0.000000 rs, h11s, h22s, h33s
|
|
0.857119 0.471133 0.000000 0.000000 rp, h11p, h22p, h33p
|
|
0.002623 0.000000 0.000000 k11p, k22p, k33p
|
|
2.19884 0. 1.2215778
|
|
|