September 2021 Archives by thread

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Starting: Wed Sep 1 11:45:31 CEST 2021
Ending: Thu Sep 30 23:40:51 CEST 2021
Messages: 130

• [QE-users] Enormous stress from a previously flawless input   Andrii Shyichuk
• [QE-users] QE6.8 ESM updated manual?   tanghong992 at outlook.com
• [QE-users] Scientific notation for numbers in QE   Hong Tang
  • [QE-users] Scientific notation for numbers in QE   Lorenzo Paulatto
• [QE-users] mos2.dyn2honon dispersion using the 'image' method   Elio Physics
  • [QE-users] mos2.dyn2honon dispersion using the 'image' method   Paolo Giannozzi
    • [QE-users] mos2.dyn2honon dispersion using the 'image' method   Elio Physics
• [QE-users] Compilation Error for QE 6.8 on MacOS 11.5   Robert Fleming
  • [QE-users] Compilation Error for QE 6.8 on MacOS 11.5   Paolo Giannozzi
    • [QE-users] Compilation Error for QE 6.8 on MacOS 11.5   Robert Fleming
• [QE-users] projection of DOS and related quantities over specific axes   Fabrizio Cossu
• [QE-users] electron lifetimes plus electron band in k-space   526587466 at qq.com
  • [QE-users] electron lifetimes plus electron band in k-space   Lorenzo Paulatto
• [QE-users] Problems compiling GIPAW with qe-6.8   E.Lora
  • [QE-users] Problems compiling GIPAW with qe-6.8   Paolo Giannozzi
• [QE-users] NEB doesn't start   Levin Rojas, Natalia
  • [QE-users] NEB doesn't start   Paolo Giannozzi
• [QE-users] vloc_of_g , a deep understanding   Elena Cannuccia
  • [QE-users] vloc_of_g , a deep understanding   Paolo Giannozzi
    • [QE-users] vloc_of_g , a deep understanding   Elena Cannuccia
• [QE-users] Broken SOC in electron-phonon calculation in QE-6.8   Vahid Askarpour
  • [QE-users] Broken SOC in electron-phonon calculation in QE-6.8   Vahid Askarpour
• [QE-users] reproducing phonon dispersion of FCC aluminum   Jacopo Simoni
  • [QE-users] reproducing phonon dispersion of FCC aluminum   Paolo Giannozzi
    • [QE-users] reproducing phonon dispersion of FCC aluminum   Vahid Askarpour
      • [QE-users] reproducing phonon dispersion of FCC aluminum   Jacopo Simoni
• [QE-users] Error in routine write_rhog (2):   Jiuyan wei
  • [QE-users] Error in routine write_rhog (2):   Paolo Giannozzi
• [QE-users] Help: How to accurately optimize the adstructure with MPB implicit solvation model?   fangyuan
• [QE-users] Help: How to accurately optimize the adstructure with MPB model?   yfang330
• [QE-users] plotband.x error   venky ch
  • [QE-users] plotband.x error   Paolo Giannozzi
    • [QE-users] plotband.x error   venky ch
    • [QE-users] plotband.x error   venky ch
      • [QE-users] plotband.x error   Lorenzo Paulatto
      • [QE-users] plotband.x error   venky ch
      • [QE-users] plotband.x error   venky ch
  • [QE-users] plotband.x error   venky ch
• [QE-users] error in pwcond calculation   Mayuri Bora
• [QE-users] error in pw.x   LEUNG Clarence
  • [QE-users] error in pw.x   Paolo Giannozzi
    • [QE-users] error in pw.x   LEUNG Clarence
• [QE-users] Tag "loto_2d" in QE-6.8   Vahid Askarpour
  • [QE-users] Tag "loto_2d" in QE-6.8   Paolo Giannozzi
    • [QE-users] Tag "loto_2d" in QE-6.8   Vahid Askarpour
• [QE-users] error in pwi2xsf.x   venky ch
  • [QE-users] error in pwi2xsf.x   lianyl
    • [QE-users] error in pwi2xsf.x   venky ch
      • [QE-users] error in pwi2xsf.x   Abolore Musari
      • [QE-users] error in pwi2xsf.x   venky ch
• [QE-users] (no subject)   Nirmal Barman
  • [QE-users] (no subject)   Nirmal Barman
• [QE-users] Seg. Fault in the writing .save step   Mahmoud Payami Shabestari
  • [QE-users] Seg. Fault in the writing .save step   Paolo Giannozzi
    • [QE-users] Seg. Fault in the writing .save step   Mahmoud Payami Shabestari
      • [QE-users] Seg. Fault in the writing .save step   Mahmoud Payami Shabestari
      • [QE-users] Seg. Fault in the writing .save step   Paolo Giannozzi
      • [QE-users] Seg. Fault in the writing .save step   Mahmoud Payami Shabestari
  • [QE-users] Seg. Fault in the writing .save step   Paolo Giannozzi
    • [QE-users] Seg. Fault in the writing .save step   Mahmoud Payami Shabestari
• [QE-users] Effective Mass Tensor unit-cell dependency   Schön, Carl-Friedrich
  • [QE-users] Effective Mass Tensor unit-cell dependency   Paolo Giannozzi
    • [QE-users] Effective Mass Tensor unit-cell dependency   Schön, Carl-Friedrich
      • [QE-users] Effective Mass Tensor unit-cell dependency   Pietro Davide Delugas
      • [QE-users] Effective Mass Tensor unit-cell dependency   Schön, Carl-Friedrich
      • [QE-users] Effective Mass Tensor unit-cell dependency   Stefano Baroni
      • [QE-users] Effective Mass Tensor unit-cell dependency   Schön, Carl-Friedrich
• [QE-users] NEB unexpected crash   Mauro Sgroi
  • [QE-users] NEB unexpected crash   Takahiro Chiba
    • [QE-users] NEB unexpected crash   Mauro Sgroi
  • [QE-users] NEB unexpected crash   Paolo Giannozzi
    • [QE-users] NEB unexpected crash   Mauro Sgroi
      • [QE-users] NEB unexpected crash   Carlo Nervi
      • [QE-users] NEB unexpected crash   Mauro Sgroi
• [QE-users] max_lines in windows version of Quantum espresso   venky ch
• [QE-users] How to calculate tangential interband matrix element along a closed loop   Tharindu W-fernando
  • [QE-users] How to calculate tangential interband matrix element along a closed loop   Paolo Giannozzi
• [QE-users] Regarding using electric field   Satyasiban Dash ph19d005
• [QE-users] help   Виктор Окулич
  • [QE-users] help   Paolo Giannozzi
• [QE-users] seeking calculation related help   Dr.A. B. Yadav SVEC
• [QE-users] Error in bands.x   Melsa Rose Ducut
  • [QE-users] Error in bands.x   Paolo Giannozzi
• [QE-users] Doubt regarding the phonon calculations of RbPbI3   Anupriya Nyayban
  • [QE-users] Doubt regarding the phonon calculations of RbPbI3   Lorenzo Paulatto
  • [QE-users] Doubt regarding the phonon calculations of RbPbI3   Anupriya Nyayban
    • [QE-users] Doubt regarding the phonon calculations of RbPbI3   Mehdi Shamekhi
  • [QE-users] Doubt regarding the phonon calculations of RbPbI3   Anupriya Nyayban
  • [QE-users] Doubt regarding the phonon calculations of RbPbI3   Eduardo Menendez
• [QE-users] qe-6.8 with CUDA compiling unsuccessfully   inagaki ctec
  • [QE-users] qe-6.8 with CUDA compiling unsuccessfully   Pietro Davide Delugas
• [QE-users] [QE-GPU] - Error 'making' pw   Anson Thomas
  • [QE-users] [QE-GPU] - Error 'making' pw   Pietro Davide Delugas
  • [QE-users] [QE-GPU] - Error 'making' pw   Paolo Giannozzi
• [QE-users] Regarding the error in routine card_atomic_species   Zahra Mosleh
  • [QE-users] Regarding the error in routine card_atomic_species   Zahra Mosleh
• [QE-users] parallel nd phonon diagonalization?   Ronald Cohen
  • [QE-users] parallel nd phonon diagonalization?   Paolo Giannozzi
• [QE-users] Errors in vc-relax calculations for a supercell   Shaona Bose
  • [QE-users] Errors in vc-relax calculations for a supercell   Paolo Giannozzi
    • [QE-users] Errors in vc-relax calculations for a supercell   Shaona Bose
• [QE-users] question about wave functions phonon code   Jacopo Simoni
  • [QE-users] question about wave functions phonon code   Paolo Giannozzi
    • [QE-users] question about wave functions phonon code   Jacopo Simoni
      • [QE-users] question about wave functions phonon code   Lorenzo Paulatto
      • [QE-users] question about wave functions phonon code   Jacopo Simoni
      • [QE-users] question about wave functions phonon code   Stefano Baroni
      • [QE-users] question about wave functions phonon code   Jacopo Simoni
  • [QE-users] question about wave functions phonon code   Stefano Baroni
• [QE-users] Epsilon.x Error   saramoh at tezu.ernet.in
  • [QE-users] Epsilon.x Error   Lorenzo Paulatto
    • [QE-users] Epsilon.x Error   saramoh at tezu.ernet.in
• [QE-users] V-relax of slabs.   Jagapathi Babu
  • [QE-users] V-relax of slabs.   Kazume NISHIDATE
    • [QE-users] V-relax of slabs.   Jagapathi Babu
• [QE-users] QE SCF covergence   Pradip Si
• [QE-users] QE SCF Convergence Error   Pradip Si
  • [QE-users] QE SCF Convergence Error   Jagapathi Babu
• [QE-users] [projwfc.x] correspondence between state labels in the console output of projwfc.x and *.projwfc_up file   lianyl
• [QE-users] Please help me to construct pw.x input file using space group and Wyckoff positions   Peshal Karki
  • [QE-users] Please help me to construct pw.x input file using space group and Wyckoff positions   Paolo Giannozzi
  • [QE-users] Please help me to construct pw.x input file using space group and Wyckoff positions   Paolo Giannozzi
    • [QE-users] Please help me to construct pw.x input file using space group and Wyckoff positions   Peshal Karki
      • [QE-users] Please help me to construct pw.x input file using space group and Wyckoff positions   Paolo Giannozzi
      • [QE-users] Please help me to construct pw.x input file using space group and Wyckoff positions   Paolo Giannozzi
      • [QE-users] Please help me to construct pw.x input file using space group and Wyckoff positions   Peshal Karki
  • [QE-users] Please help me to construct pw.x input file using space group and Wyckoff positions   Husak Michal
    • [QE-users] Please help me to construct pw.x input file using space group and Wyckoff positions   Peshal Karki
• [QE-users] Interface modeling   Ola Starkolis
• [QE-users] Fictitious kinetic energy of electrons   Mahmoud Payami Shabestari

Last message date: Thu Sep 30 23:40:51 CEST 2021
Archived on: Thu Sep 30 23:40:37 CEST 2021

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