October 2006 Archives by thread

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Starting: Sun Oct 1 05:24:34 CEST 2006
Ending: Tue Oct 31 23:50:28 CEST 2006
Messages: 277

• [Wien] cannot run opimize   Shu Miao
  • [Wien] cannot run opimize   Rong Yu
    • [Wien] cannot run opimize   Shu Miao
• [Wien] unit in optimization results   Shu Miao
  • [Wien] unit in optimization results   Gerhard Fecher
  • [Wien] unit in optimization results   RK_Thapa
    • [Wien] unit in optimization results   Gerhard Fecher
• [Wien] w2web error : sh: x: command not found   shaposh at academ.org
  • [Wien] w2web error : sh: x: command not found   Peter Blaha
• [Wien] JRJ Warning   zargham bagheri
  • [Wien] JRJ Warning   Stefaan Cottenier
• [Wien] Spin-orbit splitting   Gerhard Fecher
• [Wien] TEMP weights for optics   georg at chem.au.dk
  • [Wien] TEMP weights for optics   Peter Blaha
    • [Wien] TEMP weights for optics   Laurence Marks
• [Wien] (no subject)   Shen Li Qiu
  • [Wien] (no subject)   Stefaan Cottenier
    • [Wien] (no subject)   Peter Blaha
      • [Wien] Installation of WIEN2K in IBM AIX5L version 5.2 ML08 64-bit   Khuong P. Ong
      • [Wien] Installation of WIEN2K in IBM AIX5L version 5.2 ML08 64-bit   Torsten Andersen
• [Wien] Message from Gurpreet Singh   Gurpreet Singh
• [Wien] Error lat==ORTHOROMBIC in det_pgrp()   Manish Singh
  • [Wien] Error lat==ORTHOROMBIC in det_pgrp()   Peter Blaha
    • [Wien] DOS over certain volume in the BZ   Lukasz Plucinski
      • [Wien] DOS over certain volume in the BZ   Peter Blaha
  • [Wien] Error lat==ORTHOROMBIC in det_pgrp()   B. Yanchitsky
    • [Wien] Error lat==ORTHOROMBIC in det_pgrp()   Manish Singh
• [Wien] a question...   Jack Stean
• [Wien] Charged Cell Calculations   Laurence Marks
• [Wien] Is it au or V/m2?   jadhikari at clarku.edu
  • [Wien] Is it au or V/m2?   Peter Blaha
• [Wien] 'SECLR4' - POTRF error (again)   Roberto Iglesias
  • [Wien] 'SECLR4' - POTRF error (again)   Laurence Marks
    • [Wien] 'SECLR4' - POTRF error (again)   Roberto Iglesias
      • [Wien] 'SECLR4' - POTRF error (again)   Laurence Marks
      • [Wien] 'SECLR4' - POTRF error (again)   Roberto Iglesias
      • [Wien] 'SECLR4' - POTRF error (again)   Laurence Marks
• [Wien] Compiling Wien under Linux on PowerPC   Dr. Grigori V. Vajenine
  • [Wien] Compiling Wien under Linux on PowerPC   Peter Blaha
    • [Wien] Compiling Wien under Linux on PowerPC   Dr. Grigori V. Vajenine
      • [Wien] Compiling Wien under Linux on PowerPC   E B Lombardi
• [Wien] Reproducing the data of PRB, 46, 1321   jadhikari at clarku.edu
  • [Wien] Reproducing the data of PRB, 46, 1321   Peter Blaha
    • [Wien] Reproducing the data of PRB, 46, 1321   Singh, David J.
      • [Wien] Reproducing the data of PRB, 46, 1321   jadhikari at clarku.edu
      • [Wien] Reproducing the data of PRB, 46, 1321   Peter Blaha
• [Wien] fsgen and spaghetti   Larson, Paul M.
  • [Wien] fsgen and spaghetti   Peter Blaha
• [Wien] allocate error   tomi zaya
• [Wien] TEMP option   John Appleton
• [Wien] K-point extraction   John Appleton
  • [Wien] K-point extraction   Peter Blaha
    • [Wien] K-point extraction   Laurence Marks
• [Wien] enthalpy and RMt   youcef bouhadda
  • [Wien] enthalpy and RMt   Laurence Marks
  • [Wien] enthalpy and RMt   Stefaan Cottenier
• [Wien] optic in parallel mode   白宇
  • [Wien] optic in parallel mode   Peter Blaha
    • [Wien] optic in parallel mode   Laurence Marks
• [Wien] Spin orbit not splitting bands   lmakinistian at ceride.gov.ar
• [Wien] electronic energy and entropy   Chandrika
• [Wien] optic in parallel mode   白宇
• [Wien] Partial atomic charge analysis   Lijun Zhang
  • [Wien] Partial atomic charge analysis   Stefaan Cottenier
    • [Wien] Partial atomic charge analysis   Laurence Marks
• [Wien] DOS over certain volume in the BZ   ebruno at unime.it
• [Wien] how to create plane   RK_Thapa
  • [Wien] how to create plane   Torsten Andersen
    • [Wien] how to create plane   Laurence Marks
• [Wien] [SPAM?] AFM calculations of TM doped ZnS   ÀÃú
  • [Wien] [SPAM?] [SPAM?] AFM calculations of TM doped ZnS   Stefaan Cottenier
• [Wien] Choosing proper Emin in electron density plot   Shu Miao
  • [Wien] Choosing proper Emin in electron density plot   Peter Blaha
• [Wien] L2main - QTL-B Error   rickyso at graduate.hku.hk
• [Wien] [SPAM?] AFM calculations of TM doped ZnS   ÀÃú
  • [Wien] [SPAM?] [SPAM?] AFM calculations of TM doped ZnS   Stefaan Cottenier
• [Wien] [SPAM?] AFM calculations of TM doped ZnS   ÀÃú
  • [Wien] [SPAM?] AFM calculations of TM doped ZnS   Peter Blaha
• [Wien] Orbital polarization error   Roberto Iglesias
  • [Wien] Orbital polarization error   Laurence Marks
    • [Wien] Orbital polarization error   Roberto Iglesias
      • [Wien] Orbital polarization error   Laurence Marks
      • [Wien] Orbital polarization error   Roberto Iglesias
      • [Wien] Orbital polarization error   Peter Blaha
      • [Wien] Orbital polarization error   Roberto Iglesias
      • [Wien] Orbital polarization error   Peter Blaha
      • [Wien] Orbital polarization error   Roberto Iglesias
      • [Wien] Orbital polarization error   Peter Blaha
      • [Wien] Orbital polarization error   Laurence Marks
      • [Wien] Orbital polarization error   Roberto Iglesias
      • [Wien] Orbital polarization error   Peter Blaha
      • [Wien] Orbital polarization error   Roberto Iglesias
      • [Wien] Orbital polarization error   Roberto Iglesias
      • [Wien] Orbital polarization error   Peter Blaha
      • [Wien] Orbital polarization error   Roberto Iglesias
      • [Wien] Orbital polarization error   Roberto Iglesias
• [Wien] first announcement for WIEN2K workshop 2007   Peter Blaha
• [Wien] [SPAM?] AFM calculations of NiO   Haiming Li
  • [Wien] [SPAM?] AFM calculations of NiO   Peter Blaha
• [Wien] AFM calculations of TM doped ZnS   Haiming Li
• [Wien] Choosing proper Emin in electron density plot   Shu Miao
• [Wien] Optic and Intaband   NAJMEH SOLTANI
• [Wien] problem for running ZnO   swarup saha
  • [Wien] problem for running ZnO   Peter Blaha
• [Wien] ZnO nanowire   Jack Stean
• [Wien] AFM calculations: runsp_lapw and runafm_lapw   Haiming Li
  • [Wien] AFM calculations: runsp_lapw and runafm_lapw   Stefaan Cottenier
• [Wien] [SPAM?] AFM calculations: runsp_lapw and runafm_lapw   Haiming Li
• [Wien] Wrong plane in TiC density plot?   Shu Miao
• [Wien] [SPAM?] the energy gap of HgSe and HgTe at ambient pressure   心 陈
• [Wien] Joint error   Roberto Iglesias
  • [Wien] Joint error   Florent Boucher
    • [Wien] Joint error   Roberto Iglesias
  • [Wien] kram NaN output   Roberto Iglesias
    • [Wien] kram NaN output   Roberto Iglesias
      • [Wien] kram NaN output   Torsten Andersen
      • [Wien] kram NaN output   Iglesias Roberto
      • [Wien] kram NaN output   Torsten Andersen
      • [Wien] kram NaN output   Roberto Iglesias
      • [Wien] kram NaN output   Roberto Iglesias
      • [Wien] kram NaN output   Peter Blaha
      • [Wien] kram NaN output and absorption spectra   Iglesias Roberto
• [Wien] How to set U in LDA+U when computing the energy gap of HgTe   心 陈
  • [Wien] How to set U in LDA+U when computing the energy gap of HgTe   Trond.Brudevoll at ffi.no
    • [Wien] How to set U in LDA+U when computing the energy gap ofHgTe   Gerhard Fecher
      • 回复： Re: [Wien] How to set U in LDA+U when computing the energy gap ofHgTe   心 陈
• [Wien] About eg and t2g PDOS in Tl2Mn2O7   Hongjun Xiang
• [Wien] Wien2k Compilation on AMD Dual Operton under Suse 9.2-64 bit   Nicholas Dimakis
  • [Wien] Wien2k Compilation on AMD Dual Operton under Suse 9.2-64 bit   Michael Gurnett
    • [Wien] Wien2k Compilation on AMD Dual Operton under Suse9.2-64bit   Nicholas Dimakis
      • [Wien] Wien2k Compilation on AMD Dual Operton under Suse9.2-64bit   Michael Gurnett
      • [Wien] Wien2k Compilation on AMD Dual Operton under Suse9.2-64bit   Michael Gurnett
      • [Wien] Wien2k Compilation on AMD Dual OpertonunderSuse9.2-64bit   Nicholas Dimakis
      • [Wien] Wien2k Compilation on AMD Dual OpertonunderSuse9.2-64bit   Michael Gurnett
      • [Wien] Wien2k Compilation on AMD Dual OpertonunderSuse9.2-64bit   Nicholas Dimakis
      • [Wien] Wien2k Compilation on AMD Dual OpertonunderSuse9.2-64bit   Michael Gurnett
      • [Wien] Wien2k Compilation on AMD Dual OpertonunderSuse9.2-64bit   Michael Gurnett
• [Wien] Running Parallel Jobs   jadhikari at clarku.edu
  • [Wien] Running Parallel Jobs   Peter Blaha
    • [Wien] Running Parallel Jobs   jadhikari at clarku.edu
• [Wien] postdoctoral position at the University of Sydney, Australia   Aloysius Soon
• [Wien] Dealing with 5f electron   Chandra Bhanu Basak
  • [Wien] Dealing with 5f electron   Stefaan Cottenier
• [Wien] (no subject)   wyy-0507 at sohu.com
  • [Wien] (no subject)   Peter Blaha
• [Wien] question   wyy-0507 at sohu.com
• [Wien] Hyperfine field   Azuma, Hideto
  • [Wien] Hyperfine field   Martin Pieper
    • [Wien] Hyperfine field   Lyudmila Dobysheva
  • [Wien] Hyperfine field   Pavel Novak
• [Wien] How to construct AF II CoO supercell   Haiming Li
  • [Wien] How to construct AF II CoO supercell   Peter Blaha
• [Wien] GMAX for H   John Appleton
  • [Wien] GMAX for H   Peter Blaha
• [Wien] longin does not require password   Yuming Sun
• [Wien] Band structure calculations with spin-orbit coupling   naivebamboo Huang
  • [Wien] Band structure calculations with spin-orbit coupling   Torsten Andersen
    • [Wien] Band structure calculations with spin-orbit coupling   cesar
• [Wien] Band structure calculations with spin-orbit coupling   naivebamboo Huang
• [Wien] [SPAM?] How to construct AF II CoO supercell   Haiming Li
• [Wien] Hyperfine field   Azuma, Hideto
• [Wien] DOS of HgTe   心 陈
  • [Wien] DOS of HgTe   Stefaan Cottenier
• [Wien] adhesion clculations   Barzilai
• [Wien] wien2k workshop at Penn State   Peter Blaha
• [Wien] Benchmark on opteron - test on a fully loaded computer   Florent Boucher
  • [Wien] Benchmark on opteron - test on a fully loaded computer   Michael Gurnett
  • [Wien] Benchmark on opteron - test on a fully loaded computer   Michael Gurnett
  • [Wien] Benchmark on opteron - test on a fully loaded computer   Peter Blaha
    • [Wien] Benchmark on opteron - test on a fully loaded computer   Florent Boucher
      • [Wien] Benchmark on opteron - test on a fully loaded computer   Peter Blaha
      • [Wien] Benchmark on opteron - test on a fully loaded computer   Gerhard Fecher
      • [Wien] tasks bandmaps   Michael Gurnett
      • [Wien] Benchmark on Xeon 5140, SMP 4 cores: 2chips, 2cores/chips   Florent Boucher
      • [Wien] Benchmark on Xeon 5140, SMP 4 cores: 2chips, 2cores/chips   Laurence Marks
      • [Wien] Benchmark on Xeon 5140, SMP 4 cores: 2chips, 2cores/chips   Florent Boucher
      • [Wien] Benchmark on Xeon 5140, SMP 4 cores: 2chips, 2cores/chips   Laurence Marks
      • [Wien] Benchmark on Xeon 5140, SMP 4 cores: 2chips, 2cores/chips   Florent Boucher
      • [Wien] engel vosko problem in lapw0   Michael Gurnett
• [Wien] Convergence criterion   John Appleton
• [Wien] lsda+u with l=1   Ilya Elfimov
• [Wien] supercell   hongbo wang
  • [Wien] supercell   Peter Blaha
• [Wien] clmval   John Appleton
  • [Wien] clmval   Lyudmila Dobysheva
• [Wien] Results of ferromagnetic state is same as ferrimagnetic state?   Jinyun Li
  • [Wien] Results of ferromagnetic state is same as ferrimagnetic state?   Stefaan Cottenier
  • [Wien] Results of ferromagnetic state is same as ferrimagnetic state?   Jinyun Li
    • [Wien] Results of ferromagnetic state is same as ferrimagnetic state?   Stefaan Cottenier
• [Wien] Results of ferromagnetic state is same as ferrimagneticstate?   Gerhard Fecher
  • [Wien] Results of ferromagnetic state is same as ferrimagneticstate?   Stefaan Cottenier
• [Wien] What is the third columns on Case.eosfill   Bagher Ahmadi
  • [Wien] What is the third columns on Case.eosfill   Stefaan Cottenier
• [Wien] Benchmark on opteron - test on a fully loaded computer   XU ZUO
• [Wien] Results of ferromagnetic state is same as ferrimagneticstate?   Jinyun Li
• [Wien] Improving vacuum basis set   Laurence Marks
  • [Wien] Improving vacuum basis set   georg at chem.au.dk
    • [Wien] Improving vacuum basis set   Laurence Marks
      • [Wien] Improving vacuum basis set   georg at chem.au.dk
      • [Wien] Improving vacuum basis set   Torsten Andersen
      • [Wien] Improving vacuum basis set   Laurence Marks
• [Wien] Speedup of WIEN2k compillation   shaposh at isp.nsc.ru
  • [Wien] Speedup of WIEN2k compillation   Torsten Andersen
    • [Wien] Speedup of WIEN2k compillation   shaposh at isp.nsc.ru
      • [Wien] Speedup of WIEN2k compillation   Torsten Andersen
      • [Wien] Speedup of WIEN2k compillation   shaposh at isp.nsc.ru
      • [Wien] Speedup of WIEN2k compillation   Torsten Andersen
• [Wien] Wien2k Compilation on intel Suse10.1-64bit   hossien rahnama
  • [Wien] Wien2k Compilation on intel Suse10.1-64bit   Venkat Goruganti
• [Wien] A possible bug in symmetso   Hongjun Xiang
  • [Wien] A possible bug in symmetso   Peter Blaha
• [Wien] Is it a bug in irrep?   Jun Jiang
  • [Wien] Is it a bug in irrep?   Peter Blaha
    • [Wien] Is it a bug in irrep?   Jun Jiang
      • [Wien] Is it a bug in irrep?   Peter Blaha
• [Wien] Compiling WIEN2k for AMD Opteron with Intel ifort   shaposh at isp.nsc.ru
  • [Wien] Compiling WIEN2k for AMD Opteron with Intel ifort   shaposh at isp.nsc.ru
    • [Wien] Compiling WIEN2k for AMD Opteron with Intel ifort   Kawakami
    • [Wien] Compiling WIEN2k for AMD Opteron with Intel ifort   Florent Boucher
      • [Wien] Compiling WIEN2k for AMD Opteron with Intel ifort   shaposh at isp.nsc.ru
• [Wien] Case.inst and..   NAJMEH SOLTANI
  • [Wien] Case.inst and..   Stefaan Cottenier
• [Wien] Case.inst and..   Hongjun Xiang
• [Wien] Compiling WIEN2k for AMD Opteron with Intel ifort   shaposh at isp.nsc.ru
• [Wien] Compiling WIEN2k for AMD Opteron with Intel ifort   shaposh at isp.nsc.ru
• [Wien] Duplicate atoms found Error   Nicholas Dimakis
  • [Wien] Duplicate atoms found Error   Chandrika
• [Wien] case.inst and   NAJMEH SOLTANI
  • [Wien] case.inst and   Stefaan Cottenier
• [Wien] Band gap disappeared   ARIN CHURCH
• [Wien] about famous QTL-B and ghostband problem   Hongjun Xiang
  • [Wien] about famous QTL-B and ghostband problem   Peter Blaha
    • [Wien] How to setup the input files for a ferrimagnetic system   Yung-mau Nie
      • [Wien] How to setup the input files for a ferrimagnetic system   Stefaan Cottenier
• [Wien] Energy origin   Laurence Marks
  • [Wien] Energy origin   Florent Boucher
  • [Wien] Energy origin   John Pask
    • [Wien] Energy origin   Laurence Marks
      • [Wien] Energy origin   John Pask
      • [Wien] Energy origin   Laurence Marks
      • [Wien] Energy origin   Laurence Marks
      • [Wien] engel vosko in lapw0   Michael Gurnett
      • [Wien] engel vosko in lapw0   Gerhard Fecher
      • [Wien] engel vosko in lapw0   Michael Gurnett
      • [Wien] Energy origin   John Pask
      • [Wien] Energy origin   John Pask
• [Wien] Equivalence Problem in Wien2k? (wien97 was correct)   Peter Blaha
• [Wien] calculation of LDA+U in graphical mode   hossien rahnama
• [Wien] about famous QTL-B and ghostband problem   Hongjun Xiang
• [Wien] PORT   John Appleton
  • [Wien] PORT   Laurence Marks
• [Wien] slab speed up   John Appleton
  • [Wien] slab speed up   Rossitza Pentcheva
    • [Wien] slab speed up   Laurence Marks
• [Wien] case.inst and...   NAJMEH SOLTANI
• [Wien] compiling in fedora 6   hongch
  • [Wien] compiling in fedora 6   Michael Gurnett
    • [Wien] compiling in fedora 6   hongch
      • [Wien] compiling in fedora 6   Michael Gurnett
      • [Wien] compiling in fedora 6   Michael Gurnett
• [Wien] mini_lapw !!!!!!!!!   nadia iles
  • [Wien] mini_lapw !!!!!!!!!   Stefaan Cottenier
    • [Wien] RE : Re: mini_lapw !!!!!!!!!   nadia iles
      • [Wien] RE : Re: mini_lapw !!!!!!!!!   Stefaan Cottenier
• [Wien] ** testerror: Error in Parallel LAPW2   ARIN CHURCH
  • [Wien] ** testerror: Error in Parallel LAPW2   Peter Blaha
    • [Wien] ** testerror: Error in Parallel LAPW2   ARIN CHURCH
      • [Wien] ** testerror: Error in Parallel LAPW2   Florent Boucher
    • [Wien] ** testerror: Error in Parallel LAPW2   ARIN CHURCH
• [Wien] To L. Marks   John Appleton
  • [Wien] To L. Marks   Laurence Marks
• [Wien] error using sgroup   Faisal Mehmood
  • [Wien] error using sgroup   Peter Blaha
• [Wien] fortran compiler for AMD Turion   seRrz
• [Wien] [WIEN]A question about the calculation of the elastic constants.   ying wang
• [Wien] hyper fine field on different platforms   Björn Hülsen
• [Wien] lda+u initialization problem   Momar Diakhate

Last message date: Tue Oct 31 23:50:28 CEST 2006
Archived on: Tue Oct 31 18:00:46 CEST 2006

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