Dear developers,
This problem has been bothering me for a long time. I don’t understand why the two mobility values are not equal. I hope the EPW developers can
answer this question for us. Thanks.
Search found 21 matches
- Thu Jul 03, 2025 5:18 am
- Forum: Running the code
- Topic: Problem with mobility_nuq.fmt file
- Replies: 1
- Views: 25769
- Sun Jun 29, 2025 1:58 pm
- Forum: General discussion
- Topic: For epw5.9, how to obtain mode-resolved mobility
- Replies: 1
- Views: 592
Re: For epw5.9, how to obtain mode-resolved mobility
Dear EPW developers, I have modified the transport.f90 file to calculate both the overall RTA mobility and the mode-resolved mobility. Although the code compiles successfully and outputs data, the results differ from those in epw.out, indicating an issue with my modifications. Could the EPW team ...
- Wed Jun 25, 2025 2:20 am
- Forum: General discussion
- Topic: For epw5.9, how to obtain mode-resolved mobility
- Replies: 1
- Views: 592
For epw5.9, how to obtain mode-resolved mobility
Dear EPW developers,
For epw5.9, in order to obtain mode-resolved mobility, how to modify the code, thank you very much.
Best
Donglin
For epw5.9, in order to obtain mode-resolved mobility, how to modify the code, thank you very much.
Best
Donglin
- Sun Jun 01, 2025 6:57 am
- Forum: General discussion
- Topic: Abnormal Phonon Spectrum in EPW Including Quadrupole Polarization
- Replies: 7
- Views: 42252
Re: Abnormal Phonon Spectrum in EPW Including Quadrupole Polarization
this are the output and input files
- Sun Jun 01, 2025 6:53 am
- Forum: General discussion
- Topic: Abnormal Phonon Spectrum in EPW Including Quadrupole Polarization
- Replies: 7
- Views: 42252
Re: Abnormal Phonon Spectrum in EPW Including Quadrupole Polarization
@Nina Girotto @sponce @stiwari When I modify the initial projection orbitals of Wannier and have completed the fitting, the initial k-points and q-points are 666 and 333, respectively. When considering quadrupole polarization, the phonon spectrum output by EPW is still abnormal. I am unsure whether ...
- Mon May 26, 2025 3:17 am
- Forum: General discussion
- Topic: Abnormal Phonon Spectrum in EPW Including Quadrupole Polarization
- Replies: 7
- Views: 42252
Re: Abnormal Phonon Spectrum in EPW Including Quadrupole Polarization
for quadrupole and none quadrupole, the input file is the same, namely, epw1.in. the output files are epw1.out and epw1.out-quad.
- Wed May 21, 2025 10:24 am
- Forum: General discussion
- Topic: Abnormal Phonon Spectrum in EPW Including Quadrupole Polarization
- Replies: 7
- Views: 42252
Abnormal Phonon Spectrum in EPW Including Quadrupole Polarization
I am currently using the EPW code to calculate electron-phonon coupling and transport properties for a 3D material. I encountered an issue regarding the phonon spectrum output when including quadrupole polarization effects. Here are the details of the problem: When I perform calculations without ...
- Sun May 04, 2025 1:47 pm
- Forum: General discussion
- Topic: both eig_read = .true. and lwfpt = .true. can not be used at the same time
- Replies: 1
- Views: 15084
both eig_read = .true. and lwfpt = .true. can not be used at the same time
Dear developer In EPW, when both eig_read = .true. and lwfpt = .true. are enabled, an error occurs: task # 16 from setup_rotate_wavefunction : error # 1 symmetry equivalent k points have different energy. Use unfold_ksym = .false. However, there is no unfold_ksym keyword in EPW. How can this issue ...
- Wed Feb 12, 2025 2:46 am
- Forum: General discussion
- Topic: Discrepancy between input and output Electronic Density
- Replies: 5
- Views: 69415
Re: Discrepancy between input and output Electronic Density
You could check whether the parameter fsthick is large enough.
- Fri Dec 13, 2024 2:40 am
- Forum: General discussion
- Topic: How to obtain the scattering rate of Intervalley and Intravalley by EPW5.9
- Replies: 0
- Views: 27171
How to obtain the scattering rate of Intervalley and Intravalley by EPW5.9
Dear Developer,
I can see many paper report the scattering rate for Intervalley and Intravalley using the EPW code, but i do not know how to obain it through
EPW, could you tell me how to revised the code, thank you very much.
Regards
Donglin Guo
I can see many paper report the scattering rate for Intervalley and Intravalley using the EPW code, but i do not know how to obain it through
EPW, could you tell me how to revised the code, thank you very much.
Regards
Donglin Guo