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double-grid (dg) analysis for BSE

Posted: Mon Nov 06, 2017 11:52 am
by sitangshu
Dear Alejandro,

Thanks for your reply. (The last thread is not prompting any reply button :roll: )
I actually did that what you told. However, I am getting the error in the screen shot.
I am tar-ring the BSE report file, double_grid ndb, ndb.qp @ 300K and electron-phonon pw out files. The BSE r-file tells that it has taken the double-grid, but it stops when doing the inversion (-i). Can you please help me out...

Regards,
Sitangshu

Re: double-grid (dg) analysis for BSE

Posted: Mon Nov 06, 2017 12:12 pm
by amolina
Hi,
can you try diagonalization?
A.

Re: double-grid (dg) analysis for BSE

Posted: Mon Nov 06, 2017 12:16 pm
by sitangshu
Dear Alejandro,

I tried using diago, but it is stucking at the same level :(
Any other tricks?

Sitangshu

Re: double-grid (dg) analysis for BSE

Posted: Wed Nov 08, 2017 7:43 am
by sitangshu
Dear Alejandro,

Any suggestions....? :roll:

Regards,
Sitangshu