Search found 60 matches

by ilias-serifi
Tue Apr 23, 2019 1:25 pm
Forum: General discussion
Topic: resistivity results
Replies: 0
Views: 4140

resistivity results

hey all well i calculate the electron phonon aspects on a 2D material and i found a file which represent resistivity on the material i have 2 problems * first the file don't mention the temperatures below 10k and you know most of superconductors have a Tc<10 * the second problem is despite i had a T...
by ilias-serifi
Wed Apr 17, 2019 12:06 pm
Forum: General discussion
Topic: nkf and degaussw conversion
Replies: 3
Views: 3478

Re: nkf and degaussw conversion

Hi i still look for the convergence of the values of lambda and Tc fsthick = 15 ! eV eptemp = 0.075 ! K (same as PRB 76, 165108) degaussw = 0.001 ! eV degaussq = 0.5 ! meV dvscf_dir = '../phonon/save/' filukk = './Al.ukk' ! filkf = 'Al_band.kpt' nkf1 = 128 nkf2 = 100 nkf3 = 1 nqf1 = 256 nqf2 = 160 n...
by ilias-serifi
Wed Apr 03, 2019 2:39 pm
Forum: General discussion
Topic: electron-phonon coupling for 2D materials & unphysical Sigma
Replies: 2
Views: 3216

Re: electron-phonon coupling for 2D materials & unphysical S

hi
i think you must increase your nkf meshes cuz when you put a small degaussw you should increase your nkf grid
by ilias-serifi
Tue Apr 02, 2019 11:06 am
Forum: General discussion
Topic: nkf and degaussw conversion
Replies: 3
Views: 3478

nkf and degaussw conversion

Hi there i continue my calculations to have the good convergence can you help me to found the good parameters in bibliography lambda = 1.2 and Tc = 6.2 k for my calculations degaussw = 2 ! eV degaussq = 0.05 ! meV nkf1 = 16 nkf2 = 10 nkf3 = 1 nqf1 = 8 nqf2 = 5 nqf3 = 1 nk1 = 32 nk2 = 20 nk3 = 1 nq1 ...
by ilias-serifi
Tue Mar 26, 2019 11:26 am
Forum: General discussion
Topic: Quantum ESPRESSO 6.4 and EPW 5.1
Replies: 10
Views: 53425

Re: Quantum ESPRESSO 6.4 and EPW 5.1

Hi


Thanks a lot it's working well now

Best Regards
by ilias-serifi
Fri Mar 22, 2019 3:35 pm
Forum: General discussion
Topic: Quantum ESPRESSO 6.4 and EPW 5.1
Replies: 10
Views: 53425

Re: Quantum ESPRESSO 6.4 and EPW 5.1

Hello Sir i get a problem on the install of the newest version All done. ERROR: only 72 out of 73 tests passed. Failed test in: /home/lphe-ms/qe_release_6.4/test-suite/epw_mob_ibte_sym/ Makefile:71: la recette pour la cible run-tests-epw-parallel a choue make: *** [run-tests-epw-parallel] Erreur 1 a...
by ilias-serifi
Wed Mar 20, 2019 10:43 am
Forum: General discussion
Topic: Gets stuck at wannierize when running EPW v5.1.0
Replies: 4
Views: 3879

Re: Gets stuck at wannierize when running EPW v5.1.0

Hi
Thanks a lot i did it

Best
by ilias-serifi
Tue Mar 19, 2019 10:58 am
Forum: General discussion
Topic: Gets stuck at wannierize when running EPW v5.1.0
Replies: 4
Views: 3879

Re: Gets stuck at wannierize when running EPW v5.1.0

HI :)


where can i found this new version of epw i enter to the home page and i didn't found EPW v5.1.0



Best regard
by ilias-serifi
Thu Mar 14, 2019 11:46 am
Forum: General discussion
Topic: electron-phonon coupling for 2D materials
Replies: 16
Views: 12391

Re: electron-phonon coupling for 2D materials

Hello again i found my self working on the latest version as you see here in the begin-in of the out-put S. Ponce, E. R. Margine, C. Verdi, and F. Giustino, Comput. Phys. Commun. 209, 116 (2016) Program EPW v.5.0.0 starts on 14Mar2019 at 12:36:48 This program is part of the open-source Quantum ESPRE...
by ilias-serifi
Thu Mar 14, 2019 11:10 am
Forum: General discussion
Topic: electron-phonon coupling for 2D materials
Replies: 16
Views: 12391

Re: electron-phonon coupling for 2D materials

First of all i want to thanks you all for your interaction this affected positively the epw code family

i try till now to get the good result if i get it i will post it here

Thanks to Roxana and liu xinbao and Zhe_L


Best Regards