Dear Mohaddeseh,
Please check the posting guidelines: https://www.quantum-espresso.org/forum In particular, you should tell us which version of QE do you use, provide input and output files (e.g. via Google Drive), tell us how do you run the job (how many cores, how many k pools, etc.), which compilers and libraries do you use. But my guess is that your job crashes because you do not have enough RAM. Greetings, Iurii -- Dr. Iurii TIMROV Postdoctoral Researcher STI - IMX - THEOS and NCCR - MARVEL Swiss Federal Institute of Technology Lausanne (EPFL) CH-1015 Lausanne, Switzerland +41 21 69 34 881 http://people.epfl.ch/265334 ________________________________ From: users <[email protected]> on behalf of Mohad Abbasnejad <[email protected]> Sent: Thursday, October 1, 2020 9:03:12 PM To: Quantum ESPRESSO users Forum Subject: [QE-users] Error in Calculating the d2ns_bare matrix in ph.x Hello QE users When I am trying to calculate the d2ns_bare matrix for LDA+U phonon calculation of my structure, I am faced with this error: Calculating the d2ns_bare matrix. It might take a while! k point # 1 out of 224 k point # 2 out of 224 k point # 3 out of 224 k point # 4 out of 224 k point # 5 out of 224 k point # 6 out of 224 k point # 7 out of 224 k point # 8 out of 224 k point # 9 out of 224 k point # 10 out of 224 k point # 11 out of 224 k point # 12 out of 224 k point # 13 out of 224 k point # 14 out of 224 k point # 15 out of 224 k point # 16 out of 224 k point # 17 out of 224 k point # 18 out of 224 k point # 19 out of 224 k point # 20 out of 224 k point # 21 out of 224 k point # 22 out of 224 k point # 23 out of 224 k point # 24 out of 224 k point # 25 out of 224 k point # 26 out of 224 k point # 27 out of 224 k point # 28 out of 224 k point # 29 out of 224 k point # 30 out of 224 k point # 31 out of 224 k point # 32 out of 224 k point # 33 out of 224 k point # 34 out of 224 k point # 35 out of 224 k point # 36 out of 224 k point # 37 out of 224 k point # 38 out of 224 k point # 39 out of 224 k point # 40 out of 224 k point # 41 out of 224 k point # 42 out of 224 k point # 43 out of 224 k point # 44 out of 224 k point # 45 out of 224 k point # 46 out of 224 k point # 47 out of 224 k point # 48 out of 224 k point # 49 out of 224 k point # 50 out of 224 k point # 51 out of 224 k point # 52 out of 224 k point # 53 out of 224 k point # 54 out of 224 k point # 55 out of 224 k point # 56 out of 224 k point # 57 out of 224 k point # 58 out of 224 k point # 59 out of 224 k point # 60 out of 224 k point # 61 out of 224 k point # 62 out of 224 k point # 63 out of 224 k point # 64 out of 224 k point # 65 out of 224 k point # 66 out of 224 k point # 67 out of 224 k point # 68 out of 224 k point # 69 out of 224 k point # 70 out of 224 k point # 71 out of 224 k point # 72 out of 224 k point # 73 out of 224 k point # 74 out of 224 k point # 75 out of 224 k point # 76 out of 224 k point # 77 out of 224 k point # 78 out of 224 k point # 79 out of 224 k point # 80 out of 224 k point # 81 out of 224 k point # 82 out of 224 k point # 83 out of 224 k point # 84 out of 224 k point # 85 out of 224 k point # 86 out of 224 k point # 87 out of 224 k point # 88 out of 224 k point # 89 out of 224 k point # 90 out of 224 Application 2461263 exit codes: 174 Application 2461263 exit signals: Killed Application 2461263 resources: utime ~48102s, stime ~486s, Rss ~326644, inblocks ~0, outblocks ~183880 Any comments would be appreciated. Thank you in advance. Mohaddeseh -- --------------------------------------------------------- Mohaddeseh Abbasnejad, Assistant Professor of Physics, Faculty of Physics, Shahid Bahonar University of Kerman, Kerman, Iran P.O. Box 76169-133 Tel: +98 34 31322199 Fax: +98 34 33257434 Cellphone: +98 917 731 7514 E-Mail: [email protected]<mailto:[email protected]> Website: academicstaff.uk.ac.ir/moabbasnejad<http://academicstaff.uk.ac.ir/moabbasnejad> ---------------------------------------------------------
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