August 2004 Archives by thread

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Starting: Sun Aug 1 05:23:52 CEST 2004
Ending: Tue Aug 31 15:30:59 CEST 2004
Messages: 238

• [Wien] Meta-GGA   L. D. Marks
  • Odp: [Wien] Meta-GGA   K. Ruebenbauer
  • [Wien] Meta-GGA   Stefaan Cottenier
  • [Wien] Meta-GGA   Peter Blaha
• [Wien] Need help about compiling   Daniel Zhu
  • Odp: [Wien] Need help about compiling   K. Ruebenbauer
• [Wien] Band Gap problem   Javad Hashemifar
  • Odp: [Wien] Band Gap problem   K. Ruebenbauer
• Odp: [Wien] Band Gap problem   K. Ruebenbauer
• Odp: [Wien] Thanks   K. Ruebenbauer
• Odp: [Wien] supercell struct   K. Ruebenbauer
• [Wien] Band Gap problem   Naeini Ashkan
• [Wien] Band Gap problem   Naeini Ashkan
  • [Wien] LDA+U   Yushan Wang
    • [Wien] LDA+U   Stefaan Cottenier
• [Wien] cfg   Lena Fitting
• [Wien] for the cherge density ploting   george bush
• [Wien] WARN: Not all eigenvectors are orthogonal, and CLUSTERSIZE parameter   Valerio Bellini
  • [Wien] WARN: Not all eigenvectors are orthogonal, and CLUSTERSIZE parameter   Peter Blaha
• [WIEN] unexpected error in LAPW2   nluo at uiuc.edu
  • [WIEN] unexpected error in LAPW2   Stefaan Cottenier
    • [Wien] OT: Si(111)-sqrt(3)xsqrt(3)   Michael Gurnett
• [Wien] (no subject)   Yushan Wang
  • [Wien] (no subject)   Yushan Wang
    • [Wien] (no subject)   Stefaan Cottenier
      • [Wien] different dopants in CdTe   george bush
      • [Wien] different dopants in CdTe   Stefaan Cottenier
• [Wien] PORT, atomic position relaxation   krutibas panda
  • [Wien] PORT, atomic position relaxation   L. D. Marks
• [Wien] PORT, atomic position relaxation   krutibas panda
  • [Wien] PORT, atomic position relaxation   Stefaan Cottenier
    • [Wien] PORT, atomic position relaxation   Stefaan Cottenier
• [Wien] Monoclinic problem   Daniel Zhu
• [WIEN] unexpected error in LAPW2   nluo at uiuc.edu
• [Wien] turn off bloechl correction?   Michelle Johannes
  • [Wien] turn off bloechl correction?   Peter Blaha
  • [Wien] turn off bloechl correction?   jan kunes
• [Wien] (no subject)   Artem Urubkov
• [Wien] MINI   fabella
  • [Wien] MINI   Stefaan Cottenier
• [Wien] error in k-point parallel execution   Mahmoud Payami
  • [Wien] error in k-point parallel execution   Torsten Andersen
    • [Wien] error in locking authority file /home/mahmoud/.Xauthority   Mahmoud Payami
      • [Wien] error in locking authority file /home/mahmoud/.Xauthority   Torsten Andersen
      • [Wien] error in locking authority file /home/mahmoud/.Xauthority   Mahmoud Payami
      • [Wien] about the variables in lcore   Zhou Taojun
      • [Wien] about the variables in lcore   georg at chem.au.dk
      • [Wien] 4f in core   jan kunes
      • [Wien] 4f in core   Javad Hashemifar
      • [Wien] 4f in core   Peter Blaha
      • [Wien] how to add the additional electron   Zhou Taojun
      • [Wien] how to add the additional electron   Zhou Taojun
      • [Wien] how to add the additional electron   Stefaan Cottenier
• [Wien] How to input the structure file for the Mo2N structure   yanming Ma
  • [Wien] How to input the structure file for the Mo2N structure   Yushan Wang
    • [Wien] How to input the structure file for the Mo2N structure   yanming Ma
      • [Wien] Port option of mini   Michael Gurnett
      • [Wien] Port option of mini   L. D. Marks
      • [Wien] Port option of mini   Michael Gurnett
      • [Wien] Port option of mini   L. D. Marks
      • [Wien] How to input the structure file for the Mo2N structure   L. D. Marks
• [Wien] format of structure file   Jutta Rogal
  • [Wien] format of structure file   Peter Blaha
• [Wien] Some (bug ?) in SRC_lapwdm/l2main.frc in determining NEMIN, NEMAX   Tianjiao Zhang
  • [Wien] Some (bug ?) in SRC_lapwdm/l2main.frc in determining NEMIN, NEMAX   Peter Blaha
• [Wien] fermilevel not converged   Yushan Wang
• [Wien] How to Write the struct file??   liuzw03 at st.lzu.edu.cn
  • [Wien] How to Write the struct file??   Torsten Andersen
• [Wien] Problem compiling cif2struct on hp machines   Rebecca Nicholls
  • [Wien] Problem compiling cif2struct on hp machines   L. D. Marks
  • [Wien] Problem compiling cif2struct on hp machines   Peter Blaha
• [Wien] How to Write the struct file??   liuzw03 at st.lzu.edu.cn
  • [Wien] How to Write the struct file??   Fred Nastos
    • [Wien] Nd2Fe14B   Sherif Yehia
      • [Wien] Nd2Fe14B   Yushan Wang
      • [Wien] Nd2Fe14B   Stefaan Cottenier
      • [Wien] Nd2Fe14B   Sherif Yehia
      • [Wien] Nd2Fe14B   Stefaan Cottenier
• [Wien] How to Write the struct file??   liuzw03 at st.lzu.edu.cn
• [Wien] Nd2Fe14B   Jorissen Kevin
• [Wien] DOS : missing electrons   Abir De Sarkar
  • [Wien] DOS : missing electrons   Stefaan Cottenier
    • [Wien] DOS : missing electrons   Abir De Sarkar
      • [Wien] DOS : missing electrons   Stefaan Cottenier
      • [Wien] DOS : missing electrons   Abir De Sarkar
      • [Wien] DOS : missing electrons   Stefaan Cottenier
• [Wien] Fixed Spin Moment Calu.   Ashok Kumar Verma
• [Wien] Fixed Spin Moment Calu.   Jorissen Kevin
• [Wien] Supercell   Rezaei Behrooz
  • [Wien] Supercell   Stefaan Cottenier
• [Wien] the puzzle elastic constant   zhgh at theory.issp.ac.cn
• [Wien] P and H differences   Peter Blaha
• [Wien] q re: 'local coordinates' and px, py, pz   Peter Blaha
  • [Wien] q re: 'local coordinates' and px, py, pz   Cormac McGuinness
    • [Wien] q re: 'local coordinates' and px, py, pz   Peter Blaha
• [Wien] lapw5.def   fabella
  • [Wien] lapw5.def   georg at chem.au.dk
  • [Wien] lapw5.def   Marco Schowalter
• [Wien] error while loading shared libraries   Mahmoud Payami
  • [Wien] error while loading shared libraries   Stefaan Cottenier
    • [Wien] error while loading shared libraries   Mahmoud Payami
  • [Wien] error while loading shared libraries   Torsten Andersen
    • [Wien] error while loading shared libraries   Mahmoud Payami
    • [Wien] missing electrons   Abir De Sarkar
      • [Wien] Problem in SP+SO calculation   Shunli Shang
      • [Wien] Problem in SP+SO calculation   Torsten Andersen
      • [Wien] Problem in SP+SO calculation   Peter Blaha
      • [Wien] Problem in SP+SO calculation   Shunli Shang
      • [Wien] missing electrons   Peter Blaha
      • [Wien] missing electrons   Rossitza Pentcheva
      • [Wien] missing electrons   Peter Blaha
      • [Wien] XSPEC valence lifetime Bbroadening   Andrei Postnikov
      • [Wien] XSPEC valence lifetime Bbroadening   buero at luitz.at
    • [Wien] error while loading shared libraries   Mahmoud Payami
• [Wien] error while loading shared libraries   Jorissen Kevin
  • [Wien] error while loading shared libraries   L. D. Marks
  • [Wien] error while loading shared libraries   Mahmoud Payami
• [Wien] sign change in Mini   Jack London
  • [Wien] sign change in Mini   L. D. Marks
    • [Wien] sign change in Mini   L. D. Marks
    • [Wien] sign change in Mini   Jack London
      • [Wien] sign change in Mini   L. D. Marks
• [Wien] Cannot access userguide from w2web   L. D. Marks
  • [Wien] Cannot access userguide from w2web   Peter Blaha
• [Wien] excitation between the valence and the conduction band   Yushan Wang
• [Wien] help on saved files   Daniel Zhu
  • [Wien] help on saved files   Stefaan Cottenier
• [Wien] min force   WANG Yuan Xu
  • [Wien] min force   L. D. Marks
• [Wien] min force   WANG Yuan Xu
  • [Wien] min force   L. D. Marks
    • [Wien] min force   Jack London
      • [Wien] min force   L. D. Marks
• [Wien] forrtl: severe (174): SIGSEGV, segmentation fault occurred   Mahmoud Payami
  • [Wien] forrtl: severe (174): SIGSEGV, segmentation fault occurred   Fred Nastos
    • [Wien] forrtl: severe (174): SIGSEGV, segmentation fault occurred   Mahmoud Payami
      • [Wien] forrtl: severe (174): SIGSEGV, segmentation fault occurred   Fred Nastos
      • [Wien] forrtl: severe (174): SIGSEGV, segmentation fault occurred   L. D. Marks
      • [Wien] forrtl: severe (174): SIGSEGV, segmentation fault occurred   Mahmoud Payami
      • [Wien] forrtl: severe (174): SIGSEGV, segmentation fault occurred   L. D. Marks
      • [Wien] forrtl: severe (174): SIGSEGV, segmentation fault occurred   Mahmoud Payami
• [Wien] min force   WANG YX
  • [Wien] min force   L. D. Marks
• [Wien] sgroup: Bb and P-1   georg at chem.au.dk
  • [Wien] sgroup: Bb and P-1   georg at chem.au.dk
• [Wien] Installation help required   apu at veccal.ernet.in
• [Wien] (no subject)   Mathrubutham Rajagopalan
  • [Wien] (no subject)   Stefaan Cottenier
  • [Wien] (no subject)   Peter Blaha
• [Wien] LDA+U for La2O3   SIC CAS
  • [Wien] LDA+U for La2O3   Peter Blaha
    • [Wien] LDA+U for La2O3   SIC CAS
      • [Wien] LDA+U for La2O3   Peter Blaha
      • [Wien] LDA+U for La2O3   SIC CAS
• [Wien] Dimension Parameter   mohammadi at nano.ipm.ac.ir
  • [Wien] Dimension Parameter   Peter Blaha
  • [Wien] Dimension Parameter   Peter Blaha
    • [Wien] LDA+U   Yushan Wang
      • [Wien] [Wien2k-announce] New Version of WIEN2k   Peter Blaha
      • [Wien] [Wien2k-announce] New Version of WIEN2k   Torsten Andersen
      • [Wien] [Wien2k-announce] New Version of WIEN2k   Torsten Andersen
      • [Wien] [Wien2k-announce] New Version of WIEN2k   Peter Blaha
      • [Wien] LDA+U   thomas.mazet
      • [Wien] LDA+U   Yushan Wang
      • [Wien] LDA+U   Stefaan Cottenier
• [Wien] min force   WANG YX
  • [Wien] coordinate of rotation matrix   Zhou Taojun
  • [Wien] min force   L. D. Marks
• [Wien] post on list   Su Hao
• [Wien] submitting jobs interactivly   Travis Sefzik
  • [Wien] submitting jobs interactivly   Matthew D. Jones
• [Wien] clmsum   Travis Sefzik
  • [Wien] clmsum   Torsten Andersen
• [Wien] clmsum   Jorissen Kevin
• [Wien] Re: min force   WANG YX
• [Wien] forrtl: severe (174): SIGSEGV, segmentation fault occurred   Steven Steven Homolya
  • [Wien] forrtl: severe (174): SIGSEGV, segmentation fault occurred   Mahmoud Payami
• [Wien] Mini NEWT   Torsten Andersen
• [Wien] siteconfig does not update C compiler selection   Steven Homolya
  • [Wien] missing electrons   Abir De Sarkar
  • [Wien] siteconfig does not update C compiler selection   Peter Blaha
• [Wien] core leakage   Travis Sefzik
  • [Wien] core leakage   Saeid Jalali
    • [Wien] problem with total energy   Dong YuHui
      • [Wien] problem with total energy   Peter Blaha
    • [Wien] hexagonal str   Kulkova S.E.
      • [Wien] hexagonal str   Saeid Jalali
      • [Wien] hexagonal str   georg at chem.au.dk
• [Wien] forrtl: severe (174): SIGSEGV, segmentation fault occurred   Jorissen Kevin
• [Wien] core leakage   Jorissen Kevin
• [Wien] Re: min force   L. D. Marks
• [Wien] wien97   Travis Sefzik
  • [Wien] wien97   Torsten Andersen
• [Wien] wien97   Jorissen Kevin
• [Wien] forrtl: severe (174): SIGSEGV, segmentation fault occurred   Steven Steven Homolya
• [Wien] The explanation of file case.outputt   Dong YuHui
  • [Wien] The explanation of file case.outputt   Peter Blaha
• [Wien] Re: min force   WANG YX
  • [Wien] Re: min force   L. D. Marks
    • [Wien] Re: min force   Michael Gurnett
      • [Wien] Re: min force   L. D. Marks
    • [Wien] (no subject)   Yushan Wang
      • [Wien] (no subject)   Stefaan Cottenier
• [Wien] TiNi3 struct   Chudinov D.V.
  • [Wien] TiNi3 struct   Peter Blaha
    • [Wien] TiNi3 struct   Chudinov D.V.
      • [Wien] TiNi3 struct   Peter Blaha
      • [Wien] TiNi3 struct   Chudinov D.V.
      • [Wien] need a reply from Pro.Blaha about the w2web installing   Yushan Wang
      • [Wien] need a reply from Pro.Blaha about the w2web installing   Torsten Andersen
      • [Wien] need a reply from Pro.Blaha about the w2web installing   Peter Blaha
      • [Wien] forces in mini   KARLA
      • [Wien] forces in mini   L. D. Marks
• [Wien] OMP abort: stack overflow detected   Mahmoud Payami
  • [Wien] OMP abort: stack overflow detected   Mahmoud Payami
• [Wien] what mesh (real space) is used in WIEN2k? (Artem Urubkov)   auru
  • [Wien] what mesh (real space) is used in WIEN2k? (Artem Urubkov)   Fred Nastos
• [Wien] -Isolated molecules of benzene - my approach has not led me further than "dstart"   Komolov
  • [Wien] -Isolated molecules of benzene - my approach has not led me further than "dstart"   Andrei Postnikov
• [Wien] -Isolated molecules of benzene - my approach has not led me further than "dstart"   Jorissen Kevin
• [Wien] nn command not found   apu at veccal.ernet.in
  • [Wien] nn command not found   Saeid Jalali
• [Wien] H core state   Cesar Lazo
  • [Wien] H core state   Peter Blaha
    • [Wien] about the time   Yushan Wang
• [Wien] some elnes scripts   Michael Frotscher
• [Wien] some elnes scripts   Jorissen Kevin
• [Wien] to all TELNES users   Jorissen Kevin
  • [Wien] to all TELNES users   L. D. Marks
    • [Wien] to all TELNES users   Philippe Moreau
      • [Wien] to all TELNES users   L. D. Marks
      • [Wien] little fortran question   koitzsch
      • [Wien] little fortran question   Dr. Sharat Chandra
  • [Wien] to all TELNES users   Pavel Novak
• [Wien] to all TELNES users   Jorissen Kevin
• [Wien] surface generation   arnaud.vasseur at caramail.com
• [Wien] News from Vienna - personal info   buero at luitz.at
• [Wien] little fortran question   Andrew Smith

Last message date: Tue Aug 31 15:30:59 CEST 2004
Archived on: Wed Jul 6 14:14:18 CEST 2005

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