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| Regarding selfenergy of electron calculation http://epwforum.uk/viewtopic.php?f=3&t=1241 |
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| Author: | erneelgupta [ Sun Dec 01, 2019 2:34 pm ] |
| Post subject: | Regarding selfenergy of electron calculation |
Dear Experts, I am running epw code for finding selfenergy of electron. But an error comes, that is as given below: At line 294 of file readmat_shuffle2.f90 (unit = 81, file = '../phonons/save/si.dyn_q10') Fortran runtime error: Bad integer for item 1 in list input. before error it calculate wannier band structure successfully and also generated .chk file. Thanking you in advance |
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| Author: | hpaudya1 [ Mon Dec 02, 2019 10:10 pm ] |
| Post subject: | Re: Regarding selfenergy of electron calculation |
Hi, How many q-points do you have? The problem is from 'si.dyn_q10' file. I guess, either it may be missing, or you are specifying more q-points than is should be. Could you provide your input and output files to make sure what is going on? Best, Hari Paudyal |
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| Author: | erneelgupta [ Tue Dec 03, 2019 10:59 am ] |
| Post subject: | Re: Regarding selfenergy of electron calculation |
Dear Hari Paudyal Please see the recent post which bit modified but problem is same. (Issue in the calculation of electron self energy) viewtopic.php?f=3&t=1243 Thanking You Neelesh Gupta |
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