March 2018 Archives by thread

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Starting: Thu Mar 1 06:16:21 CET 2018
Ending: Fri Mar 30 12:35:39 CEST 2018
Messages: 123

• [QE-users] Error in ph.x   LEUNG Clarence
• [QE-users] [Pw_forum] La pseudopotential   Giuseppe Mattioli
  • [QE-users] [Pw_forum] La pseudopotential   Paolo Giannozzi
    • [QE-users] [Pw_forum] La pseudopotential   Paolo Giannozzi
      • [QE-users] [Pw_forum] La pseudopotential   Eleftheria Gkogkosi
• [QE-users] M45 edges in Xspectra   elchatz at auth.gr
• [QE-users] Error: Segmentation fault - invalid memory reference.   BENYAHIA NEZHA
  • [QE-users] Error: Segmentation fault - invalid memory reference.   Paolo Giannozzi
    • [QE-users] Error: Segmentation fault - invalid memory reference.   Paolo Giannozzi
• [QE-users] Metal-substituted semiconductor: treat as metal or insulator for phonons   Christoph Wolf
  • [QE-users] Metal-substituted semiconductor: treat as metal or insulator for phonons   Pietro Delugas
    • [QE-users] Metal-substituted semiconductor: treat as metal or insulator for phonons   Paolo Giannozzi
      • [QE-users] Metal-substituted semiconductor: treat as metal or insulator for phonons   Pietro Delugas
      • [QE-users] Metal-substituted semiconductor: treat as metal or insulator for phonons   José C. Conesa
  • [QE-users] Metal-substituted semiconductor: treat as metal or insulator for phonons   Christoph Wolf
• [QE-users] band_structure_calculation   Amin Mirzai
  • [QE-users] band_structure_calculation   Paolo Giannozzi
    • [QE-users] band_structure_calculation   Amin Mirzai
      • [QE-users] band_structure_calculation   Thomas Brumme
      • [QE-users] band_structure_calculation   Giovanni Cantele
      • [QE-users] band_structure_calculation   Amin Mirzai
      • [QE-users] band_structure_calculation   Lorenzo Paulatto
      • [QE-users] band_structure_calculation   Amin Mirzai
• [QE-users] 'vc-relax', STOP 3   tahsin özer
  • [QE-users] 'vc-relax', STOP 3   Lorenzo Paulatto
    • [QE-users] 'vc-relax', STOP 3   Paolo Giannozzi
• [QE-users] convergence problem   Sohail Ahmad
  • [QE-users] convergence problem   Dr. Thomas Brumme
    • [QE-users] convergence problem   Sohail Ahmad
      • [QE-users] convergence problem   Dr. Thomas Brumme
  • [QE-users] Convergence problem   Yusuf Zuntu
• [QE-users] (no subject)   Nuttachai Jutong
• [QE-users] Zero weight k-point in hybrid representation   Ye Luo
• [QE-users] Wrong adsorption energy   Laurens Siemons
  • [QE-users] Wrong adsorption energy   Stefano Baroni
    • [QE-users] Wrong adsorption energy   Evren Ataman
  • [QE-users] Wrong adsorption energy   Stefano de Gironcoli
    • [QE-users] Wrong adsorption energy   Laurens Siemons
• [QE-users] Partial phonon density of states   Amreen Bano
  • [QE-users] Partial phonon density of states   Mitsuaki Kawamura
  • [QE-users] Partial phonon density of states   Amreen Bano
• [QE-users] ESM calculation with tot_charge in QE   Honghui Wu
  • [QE-users] ESM calculation with tot_charge in QE   =?gb2312?B?tPO5yIxn?=
    • [QE-users] ESM calculation with tot_charge in QE   Giuseppe Mattioli
      • [QE-users] ESM calculation with tot_charge in QE   Paolo Giannozzi
• [QE-users] deformation potential with Quantum Espresso   mohammad mahdi khatami
• [QE-users] ERROR(FoX) when executing crossing nodes   Duc-Long Nguyen
  • [QE-users] ERROR(FoX) when executing crossing nodes   Duc-Long Nguyen
  • [QE-users] ERROR(FoX) when executing crossing nodes   Pietro Delugas
    • [QE-users] ERROR(FoX) when executing crossing nodes   Stefano Baroni
      • [QE-users] ERROR(FoX) when executing crossing nodes   Paolo Giannozzi
      • [QE-users] ERROR(FoX) when executing crossing nodes   Stefano Baroni
• [QE-users] Defining a radical   Laurens Siemons
• [QE-users] Quantum-ESPRESSO test run using GPU   Giovanni Cantele
  • [QE-users] Quantum-ESPRESSO test run using GPU   Pietro Bonfa'
    • [QE-users] Quantum-ESPRESSO test run using GPU   Giovanni Cantele
• [QE-users] Adding zero weight k-point in hybrid functional calculation   Ye Luo
• [QE-users] obsolete mailing list on website   Ye Luo
  • [QE-users] obsolete mailing list on website   Paolo Giannozzi
    • [QE-users] obsolete mailing list on website   Paolo Giannozzi
• [QE-users] Calculation of Elastic constants   MEGHA GOYAL
  • [QE-users] Calculation of Elastic constants   Azadi, Sam
    • [QE-users] Calculation of Elastic constants   MEGHA GOYAL
      • [QE-users] Calculation of Elastic constants   殷顺高
      • [QE-users] Calculation of Elastic constants   MEGHA GOYAL
      • [QE-users] Calculation of Elastic constants   MEGHA GOYAL
      • [QE-users] Calculation of Elastic constants   殷顺高
• [QE-users] from rdiaghg : error # 452, S matrix not positive definite   Maxim Arsentev
• [QE-users] Calculating phonon dispersions with the tetrahedron method   Tenney, Craig Michael
  • [QE-users] Calculating phonon dispersions with the tetrahedron method   Mitsuaki Kawamura
    • [QE-users] Calculating phonon dispersions with the tetrahedron method   Tenney, Craig Michael
      • [QE-users] Calculating phonon dispersions with the tetrahedron method   Mitsuaki Kawamura
• [QE-users] Calculate Kohn-Sham eigenvalues for core states   Jan Oliver Oelerich
  • [QE-users] Calculate Kohn-Sham eigenvalues for core states   Jan Oliver Oelerich
• [QE-users] stress in electric fields   Cohen, Ronald
  • [QE-users] stress in electric fields   Stefano Baroni
  • [QE-users] stress in electric fields   Paolo Giannozzi
• [QE-users] NEB fails   Denis E. Zavelev
• [QE-users] ELF for an isolated system   Guda Karthik
• [QE-users] Starting Charge   LEUNG Clarence
  • [QE-users] Starting Charge   西原慧径
• [QE-users] SGCI-MOLSSI Workshop on Gateways at ACS National Meeting on 20 March   Pamidighantam, Sudhakar
• [QE-users] Definition of phonon energies and band energies   Artur Durajski
  • [QE-users] Definition of phonon energies and band energies   Paolo Giannozzi
    • [QE-users] Definition of phonon energies and band energies   Artur Durajski
      • [QE-users] Definition of phonon energies and band energies   Stefano Baroni
• [QE-users] Mailing list archives   Paolo Giannozzi
  • [QE-users] 答复: Mailing list archives   方子明
• [QE-users] Projected a2F(w) function   Artur Durajski
• [QE-users] Possibility of jump in k-points in Bandstructure   Vahid Askarpour
  • [QE-users] Possibility of jump in k-points in Bandstructure   Vahid Askarpour
• [QE-users] Fwd: [Pw_forum] how to collect dvscf files?   Hari Paudyal
  • [QE-users] Fwd: [Pw_forum] how to collect dvscf files?   Lorenzo Paulatto
• [QE-users] error executing matdyn.x   Hari Paudyal
  • [QE-users] error executing matdyn.x   Lorenzo Paulatto
• [QE-users] QE and BoltzTraP   NEELESH GUPTA
  • [QE-users] QE and BoltzTraP   Bramha Pandey
    • [QE-users] QE and BoltzTraP   Ari P Seitsonen
• [QE-users] QUANTUM ESPRESSO AND BOLTZTRAP   alberto
• [QE-users] Question on negative phonon frequency at Gamma point   Yusuf Zuntu
  • [QE-users] Question on negative phonon frequency at Gamma point   Tenney, Craig Michael
• [QE-users] CPMD simulation at given pressure and temperature   LEUNG Clarence
  • [QE-users] CPMD simulation at given pressure and temperature   Paolo Giannozzi
• [QE-users] Meaning of some terms in input file   ade wale
  • [QE-users] Meaning of some terms in input file   Paolo Giannozzi
• [QE-users] Different output information in phonon calculation of 'GRID' and 'SPLIT'.   黄志硕
• [QE-users] a question on k-points   Yi Wang
  • [QE-users] a question on k-points   Paolo Giannozzi
• [QE-users] stresses and forces in applied electric fields   Ronald Cohen
  • [QE-users] stresses and forces in applied electric fields   Stefano Baroni
• [QE-users] Updated virtual.x to virtual_v2.x   Jingyang Wang
  • [QE-users] Updated virtual.x to virtual_v2.x   Pietro Davide Delugas
  • [QE-users] Updated virtual.x to virtual_v2.x   Lorenzo Paulatto
• [QE-users] Question | References on Lowdin charge   jibiaoli
  • [QE-users] Question | References on Lowdin charge   Paolo Giannozzi
• [QE-users] Fwd: projwfc.x out of memory   Aldo Ugolotti
  • [QE-users] Fwd: projwfc.x out of memory   Giuseppe Mattioli
  • [QE-users] Fwd: projwfc.x out of memory   Paolo Giannozzi
    • [QE-users] Fwd: projwfc.x out of memory   Aldo Ugolotti
• [QE-users] [SUSPECT ATTACHMENT REMOVED] why NEB goes ctraight   Maxim Arsentev
• [QE-users] [SUSPECT ATTACHMENT REMOVED] why NEB goes straight   Maxim Arsentev
• [QE-users] execute problem   Mohammadreza Hosseini
  • [QE-users] execute problem   Giovanni Cantele

Last message date: Fri Mar 30 12:35:39 CEST 2018
Archived on: Fri Mar 30 12:35:46 CEST 2018

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