March 2010 Archives by thread

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Starting: Mon Mar 1 10:16:24 CET 2010
Ending: Wed Mar 31 22:18:51 CEST 2010
Messages: 143

• [Wien] [Wien2k Users] Input for Hexagonal and Orthorhombic Cells   Ghosh SUDDHASATTWA
  • [Wien] [Wien2k Users] Input for Hexagonal and Orthorhombic Cells   Gerhard Fecher
  • [Wien] [Wien2k Users] Input for Hexagonal and Orthorhombic Cells   Yurko Natanzon
    • [Wien] [Wien2k Users] Input for Hexagonal and Orthorhombic Cells   Ghosh SUDDHASATTWA
• [Wien] [Wien2k Users] Typographical error??? in x kgen   Ghosh SUDDHASATTWA
• [Wien] Bad formation energies for the charged vacancies   Yurko Natanzon
• [Wien] parallel wien2k   Zhiyong Zhang
  • [Wien] parallel wien2k   Laurence Marks
• [Wien] Optic and local orbital   ali hamidani
• [Wien] tmp error   jaafar jalilian
  • [Wien] tmp error   jaafar jalilian
• [Wien] w2web, StructGen   Zhiyong Zhang
  • [Wien] w2web, StructGen   Rocquefelte
• [Wien] [Wien2k Users] Error in 3rd SCF cycle: FERMI error   Ghosh SUDDHASATTWA
  • [Wien] [Wien2k Users] Error in 3rd SCF cycle: FERMI error   Peter Blaha
    • [Wien] [Wien2k Users] Error in 3rd SCF cycle: FERMI error   Ghosh SUDDHASATTWA
    • [Wien] [Wien2k Users] Error in 3rd SCF cycle: FERMI error   Ghosh SUDDHASATTWA
• [Wien] Birch-Murnaghan equation of state   shamik chakrabarti
  • [Wien] Birch-Murnaghan equation of state   Peter Blaha
    • [Wien] Birch-Murnaghan equation of state   shamik chakrabarti
      • [Wien] Problem with LAPWSO + ORB(nmod=3)   pieper
      • [Wien] Problem with LAPWSO + ORB(nmod=3)   Peter Blaha
      • [Wien] XAS in,out of plane component   Rossitza.Pentcheva at lrz.uni-muenchen.de
      • [Wien] XAS in,out of plane component   Peter Blaha
• [Wien] Bad formation energies for the charged vacancies   John Pask
• [Wien] Radial wave function at Fermi level   Shin-ya Ayukawa
  • [Wien] Radial wave function at Fermi level   Peter Blaha
    • [Wien] Radial wave function at Fermi level   Shin-ya Ayukawa
      • [Wien] Radial wave function at Fermi level   Peter Blaha
      • [Wien] Radial wave function at Fermi level   Shin-ya Ayukawa
      • [Wien] Radial wave function at Fermi level   Peter Blaha
• [Wien] [Wien2k Users] Lattice Stability using Structure Optimization   Ghosh SUDDHASATTWA
  • [Wien] [Wien2k Users] Lattice Stability using Structure Optimization   Martin Pieper
    • [Wien] [Wien2k Users] Lattice Stability using Structure Optimization   Ghosh SUDDHASATTWA
      • [Wien] [Wien2k Users] Lattice Stability using Structure Optimization   Stefaan Cottenier
      • [Wien] [Wien2k Users] Lattice Stability usingStructure Optimization   Ghosh SUDDHASATTWA
  • [Wien] [Wien2k Users] Lattice Stability using Structure Optimization   Stefaan Cottenier
    • [Wien] [Wien2k Users] Lattice Stability using Structure Optimization   Ghosh SUDDHASATTWA
      • [Wien] [Wien2k Users] Lattice Stability using Structure Optimization   Stefaan Cottenier
• [Wien] Fermi contact Interaction   Vladimir Michaelis
  • [Wien] Fermi contact Interaction   Stefaan Cottenier
  • [Wien] Fermi contact Interaction   pieper
• [Wien] [Wien2k Users] Supercell Construction of UZr2   Ghosh SUDDHASATTWA
  • [Wien] [Wien2k Users] Supercell Construction of UZr2   Stefaan Cottenier
    • [Wien] [Wien2k Users] Supercell Construction of UZr2   Ghosh SUDDHASATTWA
      • [Wien] [Wien2k Users] Supercell Construction of UZr2   Stefaan Cottenier
      • [Wien] [Wien2k Users] Supercell Construction of UZr2   Ghosh SUDDHASATTWA
• [Wien] [Wien2k Users] Warning message in ENE for spin polarisation initialization   Ghosh SUDDHASATTWA
  • [Wien] [Wien2k Users] Warning message in ENE for spin polarisation initialization   Stefaan Cottenier
    • [Wien] [Wien2k Users] Warning message in ENE for spin polarisation initialization   Ghosh SUDDHASATTWA
    • [Wien] [Wien2k Users] Warning message in ENE for spin polarisation initialization   Ghosh SUDDHASATTWA
• [Wien] [Wien2k Users] lapw.error -"Cholesky INFO=2118"   Ghosh SUDDHASATTWA
• [Wien] installing proplem   Ibrahim, El-Said
• [Wien] installing proplem   inukai.manabu at g.mbox.nagoya-u.ac.jp
• [Wien] (no subject)   inukai.manabu at g.mbox.nagoya-u.ac.jp
• [Wien] installing proplem   inukai.manabu at g.mbox.nagoya-u.ac.jp
  • [Wien] installing proplem   JOSEPH WHITE
• [Wien] Mg-inst-file   zhchwsd
• [Wien] Problem in tetra   Kamal Chinnathambi
  • [Wien] Problem in tetra   Peter Blaha
• [Wien] [Wien2k Users] lapw.error Cholesky INFO   Ghosh SUDDHASATTWA
  • [Wien] [Wien2k Users] lapw.error Cholesky INFO   Peter Blaha
    • [Wien] [Wien2k Users] lapw.error Cholesky INFO   Ghosh SUDDHASATTWA
• [Wien] [Wien2k Users] Number of atoms in Unit Cell:case.outputsgroup or case.outputd   Ghosh SUDDHASATTWA
  • [Wien] [Wien2k Users] Number of atoms in Unit Cell:case.outputsgroup or case.outputd   Rocquefelte
    • [Wien] [Wien2k Users] Number of atoms in Unit Cell:case.outputsgroup or case.outputd   Ghosh SUDDHASATTWA
      • [Wien] [Wien2k Users] Number of atoms in Unit Cell:case.outputsgroup or case.outputd   Rocquefelte
    • [Wien] [Wien2k Users] Number of atoms in Unit Cell:case.outputsgroup or case.outputd   Ghosh SUDDHASATTWA
• [Wien] w2web xdtart -- complex selected   Zhiyong Zhang
• [Wien] w2web proplem   Ibrahim, El-Said
  • [Wien] w2web proplem   Pawel Lesniak
• [Wien] scf problem   Ibrahim, El-Said
• [Wien] w2web proplem   inukai.manabu at g.mbox.nagoya-u.ac.jp
• [Wien] w2web proplem   inukai.manabu at g.mbox.nagoya-u.ac.jp
• [Wien] w2web proplem   inukai.manabu at g.mbox.nagoya-u.ac.jp
• [Wien] [Wien2k Users] Spin Orbit Coupling in UZr2 Supercell   Ghosh SUDDHASATTWA
  • [Wien] [Wien2k Users] Spin Orbit Coupling in UZr2 Supercell   Stefaan Cottenier
    • [Wien] [Wien2k Users] Spin Orbit Coupling in UZr2 Supercell   Ghosh SUDDHASATTWA
• [Wien] init_phonon_lapw   mohaddeseh abbasnejad
• [Wien] Mg-inst-file   zhchwsd
  • [Wien] Mg-inst-file   Stefaan Cottenier
  • [Wien] Mg-inst-file   Peter Blaha
    • [Wien] Mg-inst-file   wu at ph2.uni-koeln.de
• [Wien] Overlapping spheres error   Zhiyong Zhang
  • [Wien] Overlapping spheres error   Laurence Marks
  • [Wien] Overlapping spheres error   Peter Blaha
• [Wien] Mg in GaN   E.A.Moore
• [Wien] Madelung potential   Munetaka (TAGUCHI)
• [Wien] [Wien2k Users] QTL Error in DOS Calculations   Ghosh SUDDHASATTWA
• [Wien] [Wien2k Users] Error in Internal Coordinates minimization   Ghosh SUDDHASATTWA
  • [Wien] [Wien2k Users] Error in Internal Coordinates minimization   pieper
• [Wien] running wien2k with the w2web   Josh Abeling
• [Wien] Iterative diagonalization in SCF cycles   msoumeli at physics.auth.gr
  • [Wien] Iterative diagonalization in SCF cycles   Laurence Marks
  • [Wien] Iterative diagonalization in SCF cycles   Laurence Marks
• [Wien] Iterative diagonalization in SCF cycles   msoumeli at physics.auth.gr
  • [Wien] Iterative diagonalization in SCF cycles   Laurence Marks
    • [Wien] Iterative diagonalization in SCF cycles   Oleg Rubel
• [Wien] Iterative diagonalization in SCF cycles   msoumeli at physics.auth.gr
• [Wien] molecular dynamics   Djerdj Igor
  • [Wien] molecular dynamics   Z Insepov
• [Wien] WIEN2k 09.2 installation difficulties   Chubaci
  • [Wien] WIEN2k 09.2 installation difficulties   Laurence Marks
• [Wien] [Wien2k Users] QTL Error in DOS calculations   Ghosh SUDDHASATTWA
• [Wien] Calculation of properties by wien2k for other than zero K   shamik chakrabarti
  • [Wien] Calculation of properties by wien2k for other than zero K   Peter Blaha
    • [Wien] Calculation of properties by wien2k for other than zero K   shamik chakrabarti
• [Wien] Out of the office.   debasish.banerjee at tema.toyota.com
• [Wien] [Wien2k Users] Overlapping spheres error during Optimize.job   Ghosh SUDDHASATTWA
  • [Wien] [Wien2k Users] Overlapping spheres error during Optimize.job   Rocquefelte
    • [Wien] [SPAM?] RE: [Wien2k Users] Overlapping spheres error duringOptimize.job   Ghosh SUDDHASATTWA
      • [Wien] [SPAM?] RE: [Wien2k Users] Overlapping spheres error duringOptimize.job   Rocquefelte
      • [Wien] [Wien2k Users] Overlapping spheres error during Optimize.job   Ghosh SUDDHASATTWA
• [Wien] Distortion in Band structure   JUPHY SANJAY
  • [Wien] Distortion in Band structure   Peter Blaha
• [Wien] system error *.def files not generated   Dr Aruna Chatterjee
  • [Wien] system error *.def files not generated   yasir saeed
• [Wien] .struct files   Josh Abeling
  • [Wien] .struct files   Laurence Marks
    • [Wien] .struct files   Josh Abeling
      • [Wien] .struct files   Stefaan Cottenier
• [Wien] effect of temperature on structure   shamik chakrabarti
• [Wien] Distortion in Band Structure   JUPHY SANJAY
• [Wien] system error *.def files are not created   Dr Aruna Chatterjee
• [Wien] uplapw1.error   SANJAY KUMAR SINGH
  • [Wien] uplapw1.error   Peter Blaha
• [Wien] Problem in tetra   Kamal Chinnathambi
• [Wien] Iterative diagonalization in SCF cycles   msoumeli at physics.auth.gr
  • [Wien] Iterative diagonalization in SCF cycles   Oleg Rubel
• [Wien] Iterative diagonalization in SCF cycles   msoumeli at physics.auth.gr
• [Wien] Out of the office.   debasish.banerjee at tema.toyota.com
• [Wien] [SPAM?] Help about Spin configration in FM/I/FM trilayers   Bahram Abedi
  • [Wien] [SPAM?] Re: [SPAM?] Help about Spin configration in FM/I/FM trilayers   Martin Pieper
• [Wien] Help about calculating Electron Density   Bahram Abedi
• [Wien] [Wien2k Users] Method of analysis for Option 6: Structure Optimization: parabolicfit_lapw   Ghosh SUDDHASATTWA
• [Wien] SECLR4 error in large supercells / high number of k points   Kurt Lejaeghere
  • [Wien] SECLR4 error in large supercells / high number of k points   Laurence Marks
• [Wien] [SPAM?] Help about Spin configration in FM/I/FM trilayers   Bahram Abedi
• [Wien] problem in intialization   Pooja Rana
  • [Wien] problem in intialization   Stefaan Cottenier
• [Wien] [Wien2k Users] Generation of parabolicfit_lapw script   Ghosh SUDDHASATTWA
• [Wien] xyz2struct input format   Zhiyong Zhang

Last message date: Wed Mar 31 22:18:51 CEST 2010
Archived on: Wed Mar 31 22:19:06 CEST 2010

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