Dear Boris,
Thanks a lot. I would like to see an example for exact format of input file using SQS.
Thanks in advanced,
Moshiour
Search found 4 matches
- Wed Jul 27, 2011 7:28 pm
- Forum: Ground state
- Topic: random alloy
- Replies: 3
- Views: 2485
- Wed Jul 27, 2011 9:57 am
- Forum: Ground state
- Topic: random alloy
- Replies: 3
- Views: 2485
random alloy
Hi,
Is it possible to deal with random alloy in abinit? If possible, please give me an example of fcc/bcc binary alloy (any materials) input file for 50-50 concentrations.
thanks in advanced.
Moshiour
Is it possible to deal with random alloy in abinit? If possible, please give me an example of fcc/bcc binary alloy (any materials) input file for 50-50 concentrations.
thanks in advanced.
Moshiour
- Tue Jul 26, 2011 5:53 pm
- Forum: Ground state
- Topic: Input for L12
- Replies: 2
- Views: 2113
Re: Input for L12
Dear Boris,
Thank you for replying. I have already managed to run the L12 structure.
best regards,
Moshiour
Thank you for replying. I have already managed to run the L12 structure.
best regards,
Moshiour
- Sat Jul 23, 2011 6:11 pm
- Forum: Ground state
- Topic: Input for L12
- Replies: 2
- Views: 2113
Input for L12
Hi, I am new in abinit. Last few days, i was struggling to run L12 structure, but i couldn't run it. Even i didn't find any input file for L12, L10 such common structure input file, What i have found Wurtzite structure. But it would be nice to put some common structure input file in the test. I agre...