SCTK and QE version

[ypanhtu]

Dear Dr. Kawamura,

Which QE version is compatiable with SCTK-develop or SCTK-main version? Is it compatiable with QE7.2 version which can calculate the phonon by GPU?

In addition, it seems that there is some problem to install the SCTK-develop version within the QE7.2 version.

Thanks.

Roc

HTU

[mitsuaki1987]

Dear Dr. An

Sorry for my late reply and I did not wrote the base QE version of develop branch.
The base QE version is 0e7fd34c024bde2ef2545e3aeda2bbfec770d500 that is slightly forward from QE7.2.

I am working on GPU porting but it may take time.

Best regards
Mitsuaki Kawamura

[ypanhtu]

Dear Dr. Kawamura,

It seems that there is a problem for the patch file used for the QE7.4 version. I can install the QE7.4, but it prints some errors after installing the patch for QE7.3. So, would you like to check or update the patch file for QE 7.4 version. It prints the following errors when installing the patch and QE7.4 including the patch, " patching file LR_Modules/dfpt_tetra_mod.f90
patching file LR_Modules/setup_nscf.f90
Hunk #1 FAILED at 51.
Hunk #2 succeeded at 143 (offset -4 lines).
1 out of 2 hunks FAILED -- saving rejects to file LR_Modules/setup_nscf.f90.rej
patching file PHonon/PH/alpha2f.f90
Hunk #5 succeeded at 308 (offset 1 line).
Hunk #6 succeeded at 332 (offset 1 line).
Hunk #7 FAILED at 383.
Hunk #8 succeeded at 412 (offset 3 lines).
1 out of 8 hunks FAILED -- saving rejects to file PHonon/PH/alpha2f.f90.rej
patching file PHonon/PH/do_q2r.f90
Hunk #2 succeeded at 150 (offset 1 line).
Hunk #3 FAILED at 355.
Hunk #4 FAILED at 429.
Hunk #5 FAILED at 499.
Hunk #6 FAILED at 508.
Hunk #7 succeeded at 524 (offset 8 lines).
Hunk #8 succeeded at 534 (offset 8 lines).
Hunk #9 succeeded at 605 (offset 8 lines).
Hunk #10 succeeded at 649 (offset 8 lines).
Hunk #11 succeeded at 691 (offset 8 lines).
4 out of 11 hunks FAILED -- saving rejects to file PHonon/PH/do_q2r.f90.rej
patching file PHonon/PH/elph_scdft_mod.f90
patching file PHonon/PH/elph_tetra_mod.f90
patching file PHonon/PH/q2r.f90
patching file PHonon/PH/run_nscf.f90
Hunk #2 succeeded at 105 with fuzz 1 (offset 1 line).
patching file PHonon/examples/tetra_example/run_example ",

"
make[1]: Leaving directory '/work/public/QE/QE74/LR_Modules'
make: *** [Makefile:215: lrmods] Error 1
".

Thanks so much.

Best,

Roc