10 lines
100 B
Plaintext
10 lines
100 B
Plaintext
|
[INCAR]
|
||
|
PREC = high
|
||
|
ISMEAR = 1
|
||
|
SIGMA = 0.1
|
||
|
IBRION=-1
|
||
|
ISIF=2
|
||
|
LREAL=AUTO
|
||
|
KPPRA = 1000
|
||
|
USEPOT = PAWPBE
|