June 2005 Archives by thread

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Starting: Wed Jun 1 16:08:35 CEST 2005
Ending: Thu Jun 30 20:43:28 CEST 2005
Messages: 99

• [Pw_forum] conjugate gradient diagonalization   Jaita Paul
  • [Pw_forum] conjugate gradient diagonalization   Paolo Giannozzi
• [Pw_forum] pseudopotential generation with atomic   Eduardo Ariel Menendez P
  • [Pw_forum] pseudopotential generation with atomic   Paolo Giannozzi
  • [Pw_forum] Questions on unit cell defination!   张 洪彬
    • [Pw_forum] Questions on unit cell defination!   Paolo Giannozzi
• [Pw_forum] Question of DOS at Ef   Lijun Zhang
  • [Pw_forum] Question of DOS at Ef   Paolo Giannozzi
    • [Pw_forum] Question of DOS at Ef   Lijun Zhang
  • [Pw_forum] Getting correct phonon frequencies   Mousumi Upadhyay Kahaly
    • [Pw_forum] Getting correct phonon frequencies   Stefano de Gironcoli
• [Pw_forum] Error about ph.x   Lijun Zhang
• [Pw_forum] Error about ph.x   Lijun Zhang
  • [Pw_forum] Error about ph.x   Paolo Giannozzi
• [Pw_forum] parallel version of quantum espresso.   Jaita Paul
  • [Pw_forum] parallel version of quantum espresso.   Axel Kohlmeyer
  • [Pw_forum] segmentation fault   Jaita Paul
  • [Pw_forum] segmentation fault   Axel Kohlmeyer
  • [Pw_forum] segmentation fault   Paolo Giannozzi
  • [Pw_forum] Question on occupation method!   张 洪彬
    • [Pw_forum] Question on occupation method!   Eyvaz Isaev
      • [Pw_forum] Question on occupation method!   Paolo Giannozzi
  • [Pw_forum] Questions on display Fermi Surface(continued)   张 洪彬
• [Pw_forum] how to specify atoms in a plane by XCrySDen?   Mahmoud Payami
• [Pw_forum] temperature oscillations with nose' thermostat   Massimiliano Bonomi
  • [Pw_forum] temperature oscillations with nose' thermostat   Axel Kohlmeyer
  • [Pw_forum] temperature oscillations with nose' thermostat   Konstantin Kudin
    • [Pw_forum] temperature oscillations with nose' thermostat   Axel Kohlmeyer
• [Pw_forum] some fpmd options   Massimiliano Bonomi
• [Pw_forum] how to specify atoms in a plane by XCrySDen?   Eduardo Ariel Menendez P
  • [Pw_forum] how to specify atoms in a plane by XCrySDen?   Mahmoud Payami
• [Pw_forum] Questions on display Fermi Surface(continued)   Tone Kokalj
• [Pw_forum] how to specify atoms in a plane by XCrySDen?   Tone Kokalj
  • [Pw_forum] how to specify atoms in a plane by XCrySDen?   Mahmoud Payami
  • [Pw_forum] how to specify atoms in a plane by XCrySDen?   Yosuke Kanai
    • [Pw_forum] how to specify atoms in a plane by XCrySDen?   Tone Kokalj
• [Pw_forum] XCrySDen scripts   Silviu Zilberman
  • [Pw_forum] XCrySDen scripts   Tone Kokalj
• [Pw_forum] error in phonon calculation   Mousumi Upadhyay Kahaly
  • [Pw_forum] error in phonon calculation   Eyvaz Isaev
    • [Pw_forum] error in phonon calculation   Mousumi Upadhyay Kahaly
      • [Pw_forum] error in phonon calculation   Eyvaz Isaev
      • [Pw_forum] error in phonon calculation   Mousumi Upadhyay Kahaly
      • [Pw_forum] error in phonon calculation   Eyvaz Isaev
  • [Pw_forum] error in phonon calculation   Paolo Giannozzi
• [Pw_forum] Problem while running ph.x   Mousumi Upadhyay Kahaly
  • [Pw_forum] Problem while running ph.x   Stefano de Gironcoli
• [Pw_forum] xcrysden mailing list   Tone Kokalj
  • [Pw_forum] need help about PWgui   sun jason
    • [Pw_forum] need help about PWgui   Tone Kokalj
      • [Pw_forum] need help about PWgui   Gerardo Ballabio
  • [Pw_forum] Question on how to trace a specific band on nonspecail k-points.   张 洪彬
  • [Pw_forum] RE: Pw_forum digest, Vol 1 #667 - 4 msgs   sun jason
    • [Pw_forum] RE: Pw_forum digest, Vol 1 #667 - 4 msgs   Gerardo Ballabio
    • [Pw_forum] RE: Pw_forum digest, Vol 1 #667 - 4 msgs   Tone Kokalj
  • [Pw_forum] RE: Pw_forum digest, Vol 1 #668 - 2 msgs   sun jason
    • [Pw_forum] RE: Pw_forum digest, Vol 1 #668 - 2 msgs   Eyvaz Isaev
    • [Pw_forum] LO/TO and ASR   Paolo Giannozzi
      • [Pw_forum] RE: Pw_forum digest, Vol 1 #668 - 2 msgs   Gerardo Ballabio
• [Pw_forum] restart a NEB calculation   Patricia Paredes
  • [Pw_forum] restart a NEB calculation   aaron at chips.ncsu.edu
    • [Pw_forum] restart a NEB calculation   Patricia Paredes
    • [Pw_forum] restart a NEB calculation   sbraccia carlo
• [Pw_forum] re. Atomic_Positions   Yong Jiang
  • [Pw_forum] re. Atomic_Positions   Stefano de Gironcoli
    • [Pw_forum] re. Atomic_Positions   Axel Kohlmeyer
  • [Pw_forum] Re: Segmentation fault with Setting 2 --- follow-up of Re. ATOMIC_POSITIONS   Yong Jiang
• [Pw_forum] Unedrstanding cohesive energy   Mousumi Upadhyay Kahaly
• [Pw_forum] [Fwd: Unedrstanding cohesive energy]   Mousumi Upadhyay Kahaly
  • [Pw_forum] [Fwd: Unedrstanding cohesive energy]   Paolo Giannozzi
    • [Pw_forum] Unedrstanding total energy and cohesive energy   Mousumi Upadhyay Kahaly
  • [Pw_forum] RE: Pw_forum digest, Vol 1 #673 - 6 msgs   张 洪彬
  • [Pw_forum] Question on phonon calculation.   张 洪彬
    • [Pw_forum] Question on phonon calculation.   Stefano de Gironcoli
  • [Pw_forum] RE: Pw_forum digest, Vol 1 #673 - 6 msgs   sun jason
    • [Pw_forum] RE: Pw_forum digest, Vol 1 #673 - 6 msgs   Paolo Giannozzi
      • [Pw_forum] RE: Pw_forum digest, Vol 1 #673 - 6 msgs   Paolo Giannozzi
• [Pw_forum] B3LYP calculation   Eduardo Ariel Menendez P
  • [Pw_forum] B3LYP calculation   Nicola Marzari
  • [Pw_forum] B3LYP calculation   Stefano de Gironcoli
• [Pw_forum] about parallel calculation under opteron linux cluster with mpich   Jian ZHOU
  • [Pw_forum] about parallel calculation under opteron linux cluster with mpich   Gerardo Ballabio
  • [Pw_forum] Re: about parallel calculation under opteron linux cluster with mpich   Jian ZHOU
  • [PW_Forum] Ultrasoft Troubles   John B Burdette
• [Pw_forum] Logarithmic Derivative Energies   Stephen Daunheimer
  • [Pw_forum] Logarithmic Derivative Energies   Andrea Dal Corso
• [Pw_forum] Fwd: Re: Segmentation fault with Setting 2 --- follow-up of Re. ATOMIC_POSITIONS   Yong Jiang
  • [Pw_forum] Fwd: Re: Segmentation fault with Setting 2 --- follow-up of Re. ATOMIC_POSITIONS   Eyvaz Isaev
    • [Pw_forum] Fwd: Re: Segmentation fault with Setting 2 --- follow-up of Re. ATOMIC_POSITIONS   Gerardo Ballabio
    • [Pw_forum] Fwd: Re: Segmentation fault with Setting 2 --- follow-up of Re. ATOMIC_POSITIONS   Eyvaz Isaev
  • [Pw_forum] Fwd: Re: Segmentation fault with Setting 2 --- follow-up of Re. ATOMIC_POSITIONS   Guido Roma
• [Pw_forum] Understanding "eband" & "deband" in "total energy"   Mousumi Upadhyay Kahaly
  • [Pw_forum] Understanding "eband" & "deband" in "total energy"   Konstantin Kudin
• [Pw_forum] i/o error in davcio in the phonon calculation   Jian ZHOU
  • [Pw_forum] i/o error in davcio in the phonon calculation   Eyvaz Isaev
  • [Pw_forum] about pwgui   sun jason
    • [Pw_forum] vc-relax input file   Goranka Bilalbegovic
• [Pw_forum] Re: how to find the space group and coordinates   Eduardo Ariel Menendez P
• [Pw_forum] Understanding "eband" & "deband" in "total energy"   Mousumi Upadhyay Kahaly

Last message date: Thu Jun 30 20:43:28 CEST 2005
Archived on: Tue Jul 10 14:23:54 CEST 2007

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