Search found 16 matches

by plasmon
Sat Jun 04, 2022 9:44 am
Forum: General discussion
Topic: Error when reading Mobility CB Fermi level
Replies: 0
Views: 3850

Error when reading Mobility CB Fermi level

Dear EPW developers and users, Recently I used EPW 5.4.1 to calculate the mobility of 2D WSi2N4. When I performed the mobility calculation after obtaining the electron-phonon matrix elements, EPW can not read the Mobility CB Fermi level correctly. The output information is listed below. Could you pl...
by plasmon
Fri Apr 29, 2022 8:36 am
Forum: General discussion
Topic: EPW error
Replies: 5
Views: 2860

Re: EPW error

Dear Lee,

It works. Thank you very much!

With best regards,
Hao
by plasmon
Sat Apr 23, 2022 3:44 am
Forum: General discussion
Topic: EPW error
Replies: 5
Views: 2860

Re: EPW error

Dear Lee,

Thanks for the reply. I have attached the log files here.

With best regards
Hao Zhang
by plasmon
Fri Apr 22, 2022 1:19 am
Forum: General discussion
Topic: EPW error
Replies: 5
Views: 2860

Re: EPW error

The log file for epw calculation.
by plasmon
Fri Apr 22, 2022 1:09 am
Forum: General discussion
Topic: EPW error
Replies: 5
Views: 2860

EPW error

Dear Developers, Recently I used EPW 5.4.1 to calculate electron-phonon coupling in two-dimensional WSi2N4 and met EPW running error with the information, ------------------------------------------------------------------- WANNIER : 2743.12s CPU 8273.27s WALL ( 1 calls) -----------------------------...
by plasmon
Fri Nov 13, 2020 12:49 pm
Forum: Running the code
Topic: error in MPI_FILE_OPEN
Replies: 3
Views: 2902

Re: error in MPI_FILE_OPEN

Thank you very much! It works! Dear plasmon: Probably, the following change in EPW v5.3 might be the cause of your error. Excerpt from https://docs.epw-code.org/doc/Releases.html Change in the file name of prefix.epmatwp (prefix.epmatwp1 changed into prefix.epmatwp) In addition, I don't know about E...
by plasmon
Thu Nov 12, 2020 9:03 am
Forum: Running the code
Topic: error in MPI_FILE_OPEN
Replies: 3
Views: 2902

error in MPI_FILE_OPEN

Dear developers, Recently we met a problem when using EPW5.3 on the electron-phonon matrix data calculated by EPW5.0. The error message is listed as follows, and I have attached the epw.in here. Could you please tell me how to fix this problem? Thank you very much! Best regards, Hao Zhang ``:oss/ `....
by plasmon
Thu Oct 22, 2020 1:56 am
Forum: Running the code
Topic: unknown error after wannierization job
Replies: 3
Views: 2392

Re: unknown error after wannierization job

Thank you very much! It works! Dear Hao Zhang: Since you are using EPW v5.3, you should not use nosym=.true. in nscf.in. Please read carefully the Releases page at https://docs.epw-code.org/doc/Releases.html . Additionally, your k and q grids are not commensurate. Please modify the number of grids. ...
by plasmon
Wed Oct 21, 2020 8:16 am
Forum: Running the code
Topic: unknown error after wannierization job
Replies: 3
Views: 2392

unknown error after wannierization job

Dear Developers,

Recently I met a problem when using EPW to study 2D materials. I have finished scf-ph-q2r-nscf, and some unknown error takes place after w90. I have attached the in and out files here.Could you please tell me how to fix this problem? Thank you very much!

Best,
Hao Zhang
by plasmon
Sun Sep 20, 2020 3:22 am
Forum: Running the code
Topic: Error: corrupted size vs. prev_size
Replies: 5
Views: 3977

Re: Error: corrupted size vs. prev_size

Dear Lee, Thank you very much! It works. I have a question regarding the polaron calculations. I used the following tags in the epw.in, as attached here. But it does not work, outputting nothing about polaron in the log file. Could you please tell me how to fix this problem? Thank you very much! Bes...