March 2009 Archives by thread

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Starting: Sun Mar 1 10:41:45 CEST 2009
Ending: Tue Mar 31 15:24:23 CEST 2009
Messages: 146

• [Wien] How to calculate atomic energies of unoccupied states of an isolated atom?   Martin Gmitra
• [Wien] Slater Integrals   Peter Blaha
  • [Wien] Slater Integrals   Pavel Novak
    • [Wien] Slater Integrals   Gerhard Fecher
      • [Wien] Slater Integrals   Pavel Novak
• [Wien] trial energy El in case.in1   Peter Blaha
  • [Wien] trial energy El in case.in1   Jian-Xin Zhu
    • [Wien] trial energy El in case.in1   Peter Blaha
• [Wien] primitive or conventional   Mohammad Reza Rasoulian
  • [Wien] primitive or conventional   Peter Blaha
• [Wien] Dipole moments in Bader's aim   Yurko Natanzon
• [Wien] No sumrule file   Mohit
  • [Wien] No sumrule file   Peter Blaha
• [Wien] Error in Vorb   Yurko Natanzon
  • [Wien] Error in Vorb   Aaron
• [Wien] Fortran 90 bug (?) causes Segmentation fault in DSTART (doreallocate)   Oleg Rubel
  • [Wien] Fortran 90 bug (?) causes Segmentation fault in DSTART (doreallocate)   Laurence Marks
  • [Wien] Fortran 90 bug (?) causes Segmentation fault in DSTART (doreallocate)   Gerhard Fecher
  • [Wien] Fortran 90 bug (?) causes Segmentation fault in DSTART (doreallocate)   Hong Jiang
    • [Wien] Fortran 90 bug (?) causes Segmentation fault in DSTART (doreallocate)   Gerhard Fecher
  • [Wien] Fortran 90 bug (?) causes Segmentation fault in DSTART (doreallocate)   Oleg Rubel
    • [Wien] Fortran 90 bug (?) causes Segmentation fault in DSTART (doreallocate)   Laurence Marks
• [Wien] La atom   Laurence Marks
  • [Wien] La atom   Peter Blaha
    • [Wien] La atom   Laurence Marks
      • [Wien] La atom   Jian-Xin Zhu
      • [Wien] La atom   Laurence Marks
  • [Wien] La atom   Pavel Novak
• [Wien] Support of 64-bit MPI addresses in LAPW0   Oleg Rubel
• [Wien] PDOS and total DOS of atom   Donghui Guo
  • [Wien] PDOS and total DOS of atom   Hong Jiang
  • [Wien] PDOS and total DOS of atom   Peter Blaha
• [Wien] Linux problem?   Peter Blaha
• [Wien] using suspend/resume schdeuler policy with WIEN2k para   Florent Boucher
• [Wien] qtl error   Anurag Chaudhry
• [Wien] Performance with AMD Phenom 9850 2.5GHz & Intel Q9450 2.66GHz & Xeon x3230 2.66GHz   HyunJungKim
  • [Wien] Performance with AMD Phenom 9850 2.5GHz & Intel Q9450 2.66GHz & Xeon x3230 2.66GHz   Peter Blaha
  • [Wien] Performance with AMD Phenom 9850 2.5GHz & Intel Q9450 2.66GHz & Xeon x3230 2.66GHz   Gerhard Fecher
• [Wien] forrtl: severe (24): end-of-file during read, unit 32, file $WIEN2k/case/case.broyd2001   HyunJungKim
• [Wien] compiling on a Intel MacPro with Intel FC and MKL   Anurag Chaudhry
• [Wien] Ca3CoMnO6-CRYSTAL   zhchwsd at 163.com
• [Wien] Ca3CoMnO6-CRYSTAL   Michael Fischer
• [Wien] convert clmsum to gaussian cube   Yurko Natanzon
  • [Wien] convert clmsum to gaussian cube   Peter Blaha
    • [Wien] convert clmsum to gaussian cube   Yurko Natanzon
    • [Wien] convert clmsum to gaussian cube   Florent Boucher
  • [Wien] convert clmsum to gaussian cube   Alberto Otero de la Roza
• [Wien] warning: !!! Struct file is not consistent with space group found   Tarik Ouahrani
  • [Wien] warning: !!! Struct file is not consistent with space group found   Peter Blaha
    • [Wien] warning: !!! Struct file is not consistent with space group found   Tarik Ouahrani
• [Wien] Bug Report: Wien2k 9.1   Jeffery Aguiar
  • [Wien] Bug Report: Wien2k 9.1   Scott Beardsley
• [Wien] compilation with Intel cprof_p_11.0.074   Peter Artamonov
  • [Wien] compilation with Intel cprof_p_11.0.074   Peter Blaha
• [Wien] FW: compilation with Intel cprof_p_11.0.074   Peter Artamonov
• [Wien] OOB error in lapw2   Scott Beardsley
  • [Wien] OOB error in lapw2   Laurence Marks
    • [Wien] OOB error in lapw2   Scott Beardsley
• [Wien] thanks   Dr.R.K.Thapa
• [Wien] WIEN2k workshop   Peter Blaha
• [Wien] Normalization scheme in X-ray absorption spectra calculation   Lily Anh
• [Wien] request_pl.   Dr.R.K.Thapa
  • [Wien] request_pl.   Ricardo Faccio
    • [Wien] request_pl.   Jian-Xin Zhu
      • [Wien] request_pl.   Ricardo Faccio
• [Wien] About BoltztraP   sd.wang000
• [Wien] How to select proper K-mesh for slab   Donghui Guo
• [Wien] lapw2 mpi parallelization limits   Scott Beardsley
  • [Wien] lapw2 mpi parallelization limits   Peter Blaha
    • [Wien] lapw2 mpi parallelization limits   Laurence Marks
    • [Wien] lapw2 mpi parallelization limits   Scott Beardsley
      • [Wien] lapw2 mpi parallelization limits   Peter Blaha
      • [Wien] lapw2 mpi parallelization limits   Scott Beardsley
      • [Wien] lapw2 mpi parallelization limits   Laurence Marks
      • [Wien] lapw2 mpi parallelization limits   Scott Beardsley
      • [Wien] lapw2 mpi parallelization limits   Laurence Marks
      • [Wien] lapw2 mpi parallelization limits   Scott Beardsley
      • [Wien] lapw2 mpi parallelization limits   Laurence Marks
      • [Wien] lapw2 mpi parallelization limits   Laurence Marks
      • [Wien] lapw2 mpi parallelization limits   Scott Beardsley
      • [Wien] lapw2 mpi parallelization limits   Peter Blaha
• [Wien] Reference energy for eigenvalues   Oleg Rubel
  • [Wien] Reference energy for eigenvalues   Peter Blaha
    • [Wien] Reference energy for eigenvalues   Oleg Rubel
      • [Wien] Reference energy for eigenvalues   Peter Blaha
      • [Wien] Reference energy for eigenvalues   Oleg Rubel
• [Wien] Consulting   sd.wang000
• [Wien] About Fermi   sd.wang000
• [Wien] spin-orbit coupling and partial charges   Ulrich Wedig
  • [Wien] spin-orbit coupling and partial charges   Peter Blaha
• [Wien] How to plot 2 dimensional FermiSurface   2002jiaxiaowen
  • [Wien] How to plot 2 dimensional FermiSurface   Peter Blaha
    • [Wien] [SPAM?] Fe.struct   蔡孟秋
      • [Wien] [SPAM?] about the Fe.struct   蔡孟秋
    • [Wien] How to plot 2 dimensional FermiSurface   2002jiaxiaowen
      • [Wien] How to plot 2 dimensional FermiSurface   Peter Blaha
      • [Wien] How to plot 2 dimensional FermiSurface   2002jiaxiaowen
      • [Wien] How to plot 2 dimensional FermiSurface   Peter Blaha
      • [Wien] How to plot 2 dimensional FermiSurface   2002jiaxiaowen
      • [Wien] How to plot 2 dimensional FermiSurface   Peter Blaha
• [Wien] x kgen throwing out-of-range warnings   Scott Beardsley
  • [Wien] x kgen throwing out-of-range warnings   Peter Blaha
    • [Wien] x kgen throwing out-of-range warnings   Laurence Marks
      • [Wien] x kgen throwing out-of-range warnings   Scott Beardsley
      • [Wien] x kgen throwing out-of-range warnings   Laurence Marks
      • [Wien] x kgen throwing out-of-range warnings   Peter Blaha
• [Wien] AFM supercell   ROBERTO LUIS IGLESIAS PASTRANA
  • [Wien] AFM supercell   Gerhard Fecher
  • [Wien] AFM supercell   Roberto Iglesias
  • [Wien] AFM supercell   Peter Blaha
    • [Wien] AFM supercell   ROBERTO LUIS IGLESIAS PASTRANA
• [Wien] problem_phonon_lapw   ritabrata bhowmick
  • [Wien] problem_phonon_lapw   Peter Blaha
    • [Wien] RES: problem_phonon_lapw   catff
    • [Wien] RES: problem_phonon_lapw   catff
      • [Wien] RES: RES: problem_phonon_lapw   catff
    • [Wien] RES: problem_phonon_lapw   catff
  • [Wien] problem_phonon_lapw   Peter Blaha
• [Wien] INSTALLATION   catff
  • [Wien] INSTALLATION   Peter Blaha
• [Wien] I2/a to b2/b space group   ali hamidani
• [Wien] localization of Mn t2g orbital   shamik chakrabarti
  • [Wien] localization of Mn t2g orbital   Peter Blaha
  • [Wien] localization of Mn t2g orbital   Pavel Novak
    • [Wien] localization of Mn t2g orbital   shamik chakrabarti
• [Wien] Excitation   Assad at uaeu.ac.ae
• [Wien] a question about calculating elastic constants!   shxincui at yahoo.com
• [Wien] [SPAM?] Re : a question about calculating elastic constants!   rajendra singh
• [Wien] [SPAM?] Re : a question about calculating elastic constants!   shouxincui shouxincui
• [Wien] Total energy in electron doping case   =?iso-2022-jp?B?GyRCNVw6aj0oPVMbKEI=?=
• [Wien] I2/a to b2/b space group   ali hamidani
  • [Wien] I2/a to b2/b space group   E.A.Moore
  • [Wien] I2/a to b2/b space group   Rocquefelte
• [Wien] problem with expand_lapw   nassiba nassiba
  • [Wien] problem with expand_lapw   Tarik Ouahrani
• [Wien] regarding struct file   Arun Kr. Chatterjee
  • [Wien] regarding struct file   Rocquefelte
• [Wien] Generation of K-Points in FBZ   ronunez at gauss.mat.uson.mx
  • [Wien] Generation of K-Points in FBZ   Peter Blaha
  • [Wien] Generation of K-Points in FBZ   Roberto Nunez Gonzalez
• [Wien] plot 2D FermiSurface   2002jiaxiaowen
  • [Wien] plot 2D FermiSurface   Peter Blaha
• [Wien] w2web loads 100% CPU   Yurko Natanzon
• [Wien] phonon2wien_problem   rito at rcais.res.in
  • [Wien] case.rho units   Lukasz Plucinski
    • [Wien] case.rho units   Yurko Natanzon

Last message date: Tue Mar 31 15:24:23 CEST 2009
Archived on: Tue Mar 31 15:24:32 CEST 2009

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