mirror of
https://github.com/triqs/dft_tools
synced 2024-12-22 12:23:41 +01:00
13 lines
134 B
INI
13 lines
134 B
INI
|
[General]
|
||
|
|
||
|
[PLO Group 1]
|
||
|
|
||
|
IONS = 5 6 7 8
|
||
|
EMIN = -0.6
|
||
|
EMAX = 2.7
|
||
|
LSHELL = 2
|
||
|
RTRANSFORM =
|
||
|
0.0 0.0 0.0 0.0 1.0
|
||
|
0.0 0.0 1.0 0.0 0.0
|
||
|
|