Search found 9 matches

by LiuHD
Tue Jan 16, 2024 2:11 am
Forum: General discussion
Topic: system_ 2D in EPW5.8
Replies: 4
Views: 9388

Re: system_ 2D in EPW5.8

Dear Sabya,

Thanks for your reply.

Other one question troubling me is whether the table can decrease the memory per pool when calculate the superconducting gaps at low temperatures?

Best regards,
LiuHD.
by LiuHD
Sun Jan 14, 2024 3:54 am
Forum: General discussion
Topic: system_ 2D in EPW5.8
Replies: 4
Views: 9388

Re: system_ 2D in EPW5.8

Dear mxh,

Thanks for your questions about the label "system_2d" of latest EPW version. We also have the same problem about it.

We sincerely hope that the problem can be resolved as soon as possible!

Best wishes,
LiuHD
by LiuHD
Thu Dec 21, 2023 9:58 am
Forum: Running the code
Topic: How to evaluate the memory needed for a computation?
Replies: 3
Views: 16382

Re: How to evaluate the memory needed for a computation?

Dear Si,
Thanks for your question about this problem! We are usually puzzled by it.

Sincerely hope the problem can be resolved!

Best wishes,
Liu.
by LiuHD
Mon Nov 20, 2023 9:17 am
Forum: Running the code
Topic: QE7.2 problem
Replies: 2
Views: 16787

Re: QE7.2 problem

Dear Sabya,

Thanks! I will see it!

Thanks again.

Beat wishes,
Liu HD
by LiuHD
Sat Nov 18, 2023 4:58 am
Forum: Running the code
Topic: QE7.2 problem
Replies: 2
Views: 16787

QE7.2 problem

Dear developer:

When I use the version 7.2 of QE to calculate the electron-phonon coupling with ph.x, a problem "Electron-phonon calculations with PAW not tested" appear!

The QE7.2 supports the PAW calculations?

Thank,
LiuHD
by LiuHD
Wed Mar 22, 2023 4:58 am
Forum: General discussion
Topic: Interpreting the results of the monolayer MgB2
Replies: 7
Views: 25561

Re: Interpreting the results of the monolayer MgB2

Hello,
We also face the same problems that some negative gaps emerge.

Could you tell us how you solved this problem?

We will sincerely appreciate the help you provide.

Best Wishes.
by LiuHD
Tue Dec 13, 2022 12:33 am
Forum: General discussion
Topic: EPW-pp.py of PAW
Replies: 3
Views: 6149

Re: EPW-pp.py of PAW

Moreover, there is an another question that which symmetry is borken, time or space symmetry?
by LiuHD
Tue Dec 13, 2022 12:19 am
Forum: General discussion
Topic: EPW-pp.py of PAW
Replies: 3
Views: 6149

Re: EPW-pp.py of PAW

Thank you very much. It is nice useful for us. Thanks again.
by LiuHD
Wed Nov 30, 2022 8:10 am
Forum: General discussion
Topic: EPW-pp.py of PAW
Replies: 3
Views: 6149

EPW-pp.py of PAW

Dear all, One issue occurs when we calculated the phonon with PAW pseudopotential. In /tmp/_ph0, there are additional prefix.dvscf+Number and prefix.dvscf_paw+Number, except for prefix.dvscf1 and prefix.dvscf_paw1. The same situation appears in prefix.q_Number. For example, in the /tmp/_ph0/, prefix ...