Dear All VASP Users,
I am new vasp user. i made Si molecule. the output given at the outcar file, but problem is that I did not understand "how to read the file". Please anybody help me...
Where the fermi energy? where the band structure and basic parameter? please specfy the output..
Thank you.
OUTCAR File
Moderators: Global Moderator, Moderator
-
sanjaysahare20
- Newbie
- Posts: 4
- Joined: Mon Nov 23, 2009 6:49 am
OUTCAR File
Last edited by sanjaysahare20 on Thu Feb 04, 2010 1:41 pm, edited 1 time in total.
-
admin
- Administrator
- Posts: 2921
- Joined: Tue Aug 03, 2004 8:18 am
- License Nr.: 458
OUTCAR File
please simply use any standard editor to read an ASCII file and take some time to carefully go through this file, the written output is well documented in the file.
all basic parameters are listed at the beginning of the file.
for the Fermi level search for the string E-fermi, the band structure data are written for each ionic step.
[ Edited Thu Feb 04 2010, 03:05PM ]
all basic parameters are listed at the beginning of the file.
for the Fermi level search for the string E-fermi, the band structure data are written for each ionic step.
[ Edited Thu Feb 04 2010, 03:05PM ]
Last edited by admin on Thu Feb 04, 2010 2:01 pm, edited 1 time in total.