Begin forwarded message:
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> From: Microsoft.com team
> Date: 29 Aug 2024 at 18:26
> To: General discussion list for Quantum ESPRESSO developers
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> Subject: Fwd: Termination of magnetic calulations
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Begin forwarded message:
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> From: Microsoft.com team
> Date: 16 Mar 2024 at 20:46
> To: General discussion list for Quantum ESPRESSO developers
>
> Subject: Fwd: thermo_pw DOS CRASH
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Dear Husak
Thanks a lot for your kind reply.
However, I need to perform some dft calculations on isolated molecules and in
some examples they introduced the atomic coordinates in the scf file for
isolated molecules, but the coordinates were different from those produced by
avogadro and
Dear Lorenzo
Thanks a lot for your help.
I just would like to know after increasing my quota may I restart my
computations from the last point and how it can be done or should I restart
from the beginning.
Thanks a lot once again for your efforts.
Tarek Hammad.
