Hi. i Had the same problem. If you are specifying the bandgap in bdgw, lets say bdgw 4 5, change it to something like
bdgw 3 6 or bdgw 2 7. got the gap values after doing this
Search found 2 matches
- Mon May 03, 2021 8:18 am
- Forum: Many-body perturbation theory
- Topic: Gap values not written
- Replies: 2
- Views: 9738
- Sat May 01, 2021 1:40 am
- Forum: Many-body perturbation theory
- Topic: Trying to obtain gamma bandgap of CsSnI3
- Replies: 0
- Views: 19549
Trying to obtain gamma bandgap of CsSnI3
Hi.
I'm trying to get the gw bandgap of CsSnI3 at gamma. But my run of abinit stops just before the iteration cycles. If you know what is the issue here, please help me out. The input and output files are attached to this post.
Thank you
I'm trying to get the gw bandgap of CsSnI3 at gamma. But my run of abinit stops just before the iteration cycles. If you know what is the issue here, please help me out. The input and output files are attached to this post.
Thank you