November 2019 Archives by thread

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Starting: Fri Nov 1 05:36:03 CET 2019
Ending: Wed Nov 27 16:58:46 CET 2019
Messages: 127

• [QE-users] Error in interploation of IFCs by matdyn.x   Hao Gao
  • [QE-users] Error in interploation of IFCs by matdyn.x   Lorenzo Paulatto
    • [QE-users] [SUSPECT ATTACHMENT REMOVED] Re:Re: Error in interploation of IFCs by matdyn.x   Hao Gao
• [QE-users] Fw: Problem with SOC   David Kostov
  • [QE-users] Fw: Problem with SOC   Guido Menichetti
    • [QE-users] Fw: Problem with SOC   David Kostov
      • [QE-users] Fw: Problem with SOC   Guido Menichetti
      • [QE-users] Fw: Problem with SOC   David Kostov
• [QE-users] DFT + U not working on Sn 4d   후신 부지드
  • [QE-users] DFT + U not working on Sn 4d   Ari P Seitsonen
  • [QE-users] DFT + U not working on Sn 4d   Matteo Cococcioni
  • [QE-users] DFT + U not working on Sn 4d   후신 부지드
• [QE-users] charge is wrong: smearing is needed   Mohamed Ahmed Abd-Elati
  • [QE-users] charge is wrong: smearing is needed   Ari P Seitsonen
• [QE-users] Problem using ph.x with DFPT+U in QE 6.4(.1)   Shenli Zhang
• [QE-users] relation between Hubbard-U and core charge?   Malte Sachs
• [QE-users] Plotting a 3D band plot using Quantum Espresso   Vasilios Passias
• [QE-users] How to plot phonon band structure with LO-TO splitting   Lorenzo Paulatto
  • [QE-users] How to plot phonon band structure with LO-TO splitting   Dr. K. C. Bhamu
    • [QE-users] How to plot phonon band structure with LO-TO splitting   Lorenzo Paulatto
      • [QE-users] How to plot phonon band structure with LO-TO splitting   Dr. K. C. Bhamu
• [QE-users] compiling GPU enabled version of QE: q-e-gpu-qe-gpu-6.4.1a1.tar.gz   Mohammad Moaddeli
• [QE-users] users Digest, Vol 148, Issue 3   Hussain Ali
  • [QE-users] users Digest, Vol 148, Issue 3   Pietro Davide Delugas
• [QE-users] ERROR(FoX), Cannot open file   Ben Comer
  • [QE-users] ERROR(FoX), Cannot open file   Pietro Davide Delugas
    • [QE-users] ERROR(FoX), Cannot open file   Ben Comer
      • [QE-users] ERROR(FoX), Cannot open file   Paolo Giannozzi
      • [QE-users] ERROR(FoX), Cannot open file   Ben Comer
      • [QE-users] ERROR(FoX), Cannot open file   Paolo Giannozzi
      • [QE-users] ERROR(FoX), Cannot open file   Paolo Giannozzi
      • [QE-users] ERROR(FoX), Cannot open file   Ben Comer
      • [QE-users] ERROR(FoX), Cannot open file   Ben Comer
• [QE-users] users Digest, Vol 148, Issue 4   Mayuri Bora
  • [QE-users] users Digest, Vol 148, Issue 4   Mayuri Bora
• [QE-users] Calculate phonons only at the interface   Christian helman
  • [QE-users] Calculate phonons only at the interface   Hari Paudyal
    • [QE-users] Calculate phonons only at the interface   thorgalg
      • [QE-users] Calculate phonons only at the interface   Paolo Giannozzi
    • [QE-users] Calculate phonons only at the interface   Christian helman
      • [QE-users] Calculate phonons only at the interface   Hari Paudyal
• [QE-users] On the use of the modified Becke-Johnson (TB09) functional   Fabio Costa
  • [QE-users] On the use of the modified Becke-Johnson (TB09) functional   Fabrizio Ferrari
    • [QE-users] On the use of the modified Becke-Johnson (TB09) functional   Fabrizio Ferrari
• [QE-users] Fourier Interpolation of Phonon Bandstructure   Ankit Sharma
• [QE-users] MPI python   Anuja Chanana
  • [QE-users] MPI python   Offermans Willem
• [QE-users] Error in routine cdiaghg (1590): S matrix not positive definite   Jibiao Li
• [QE-users] end-of-file fortran error in gipaw nmr calculation   Siebe Vanlommel
• [QE-users] Pressure/Stress in vc-relax calculation   Inna Martha Nangoi
• [QE-users] Question about NEB   Yeon, Jejoon
• [QE-users] [Pw_forum] input file for isolated atom   Ajmal Ghan
  • [QE-users] [Pw_forum] input file for isolated atom   Ari P Seitsonen
    • [QE-users] [Pw_forum] input file for isolated atom   Ajmal Ghan
      • [QE-users] [Pw_forum] input file for isolated atom   Giuseppe Mattioli
      • [QE-users] [Pw_forum] input file for isolated atom   Ajmal Ghan
      • [QE-users] [Pw_forum] input file for isolated atom   Yves Ferro
      • [QE-users] [Pw_forum] input file for isolated atom   Ajmal Ghan
• [QE-users] Magnetic anisotropy energy in magnetic insulators   Sitangshu Bhattacharya
  • [QE-users] Magnetic anisotropy energy in magnetic insulators   Sitangshu Bhattacharya
    • [QE-users] Magnetic anisotropy energy in magnetic insulators   BARRETEAU Cyrille
  • [QE-users] Magnetic anisotropy energy in magnetic insulators   Christoph Wolf
• [QE-users] CP simulation constant of motion increases on thermostatting of electrons   Rashid Rafeek V Valappil
• [QE-users] xml parser for data-file-schema.xml in qe   Sonu Kumar
  • [QE-users] xml parser for data-file-schema.xml in qe   Pietro Davide Delugas
    • [QE-users] xml parser for data-file-schema.xml in qe   Sonu Kumar
• [QE-users] Problem using ph.x with DFPT+U in QE 6.4.(1)   Shenli Zhang
  • [QE-users] Problem using ph.x with DFPT+U in QE 6.4.(1)   Timrov Iurii
  • [QE-users] Problem using ph.x with DFPT+U in QE 6.4.(1)   Shenli Zhang
    • [QE-users] Problem using ph.x with DFPT+U in QE 6.4.(1)   Paolo Giannozzi
      • [QE-users] Problem using ph.x with DFPT+U in QE 6.4.(1)   Timrov Iurii
      • [QE-users] Problem using ph.x with DFPT+U in QE 6.4.(1)   Paolo Giannozzi
      • [QE-users] Problem using ph.x with DFPT+U in QE 6.4.(1)   Shenli Zhang
      • [QE-users] Problem using ph.x with DFPT+U in QE 6.4.(1)   Timrov Iurii
• [QE-users] How to know if all pseudo potentials are normconserving   John McFarland
  • [QE-users] How to know if all pseudo potentials are normconserving   Paolo Giannozzi
• [QE-users] Inconsistency of atomic species in neb.x calculations   Mladenovic Marko
  • [QE-users] Inconsistency of atomic species in neb.x calculations   Giuseppe Mattioli
    • [QE-users] Inconsistency of atomic species in neb.x calculations   Mladenovic Marko
• [QE-users] post-doc position @ Gemmate Technologies srl   Giuseppe Mattioli
• [QE-users] Fwd: How to use software.   GAMERS STREAM
• [QE-users] Post-Doc position @CNR-NANO Pisa (Italy)   Guido Menichetti
• [QE-users] What is the optimum conv_thr for MAE calculation   후신 부지드
  • [QE-users] What is the optimum conv_thr for MAE calculation   Christoph Wolf
• [QE-users] Question on output   Pablo García Risueño
  • [QE-users] Question on output   Paolo Giannozzi
    • [QE-users] Question on output   Pablo García Risueño
• [QE-users] Question on 2D materials'phonons   w
• [QE-users] GRID setup calculation produces no output, stops early.   M.J. Hutcheon
  • [QE-users] GRID setup calculation produces no output, stops early.   Paolo Giannozzi
    • [QE-users] GRID setup calculation produces no output, stops early.   M.J. Hutcheon
• [QE-users] quantum espresso   GAMERS STREAM
  • [QE-users] quantum espresso   Will DeBenedetti
• [QE-users] quantum espressso   GAMERS STREAM
  • [QE-users] quantum espressso   Giovanni Cantele
• [QE-users] how to make scf input file   GAMERS STREAM
  • [QE-users] how to make scf input file   Ajmal Ghan
• [QE-users] error in cppp.x   Hussain Ali
  • [QE-users] error in cppp.x   Pietro Delugas
• [QE-users] subspace diagonalization in QE-6.4.1   Manoel VF Barrionuevo
• [QE-users] error in hp.x   Bin Shao
  • [QE-users] error in hp.x   Paolo Giannozzi
    • [QE-users] error in hp.x   Bin Shao
      • [QE-users] error in hp.x   Paolo Giannozzi
      • [QE-users] error in hp.x   Bin Shao
• [QE-users] Images in signature   Paolo Giannozzi
• [QE-users] Convergency problem   Ganes Shukri
  • [QE-users] Convergency problem   Giovanni Cantele
• [QE-users] create scf.in file   GAMERS STREAM
  • [QE-users] create scf.in file   Will DeBenedetti
• [QE-users] Quantum espresso installation problem in MAC   Kanka Ghosh
  • [QE-users] Quantum espresso installation problem in MAC   Will DeBenedetti
    • [QE-users] Quantum espresso installation problem in MAC   Kanka Ghosh
  • [QE-users] Quantum espresso installation problem in MAC   Paolo Giannozzi
    • [QE-users] Quantum espresso installation problem in MAC   Kanka Ghosh
      • [QE-users] Quantum espresso installation problem in MAC   Paolo Giannozzi
  • [QE-users] Quantum espresso installation problem in MAC   Ye Luo
    • [QE-users] Quantum espresso installation problem in MAC   Mejia Rodriguez, Daniel
• [QE-users] [SUSPICIOUS MESSAGE] strange behavior of assume_isolated = 'esm' in QE 6.4.1   Giuseppe Mattioli
• [QE-users] convergence of hp.x   Gaoxue Wang
  • [QE-users] convergence of hp.x   Timrov Iurii
    • [QE-users] convergence of hp.x   Gaoxue Wang
      • [QE-users] convergence of hp.x   Timrov Iurii
• [QE-users] Size of the temporary files   Jatin Kashyap
  • [QE-users] Size of the temporary files   Paolo Giannozzi
    • [QE-users] Size of the temporary files   Paolo Giannozzi
• [QE-users] Improve convergence with noncollinear calculation   Christoph Wolf

Last message date: Wed Nov 27 16:58:46 CET 2019
Archived on: Wed Nov 27 16:57:50 CET 2019

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