November 2009 Archives by thread

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Starting: Tue Nov 3 08:39:04 UTC 2009
Ending: Fri Nov 27 16:32:21 UTC 2009
Messages: 55

• [CP2K:2373] Re: Different version, different result?   Juerg Hutter
  • Different version, different result?   Andy Van Yperen-De Deyne
• call graph   Toon Verstraelen
  • [CP2K:2375] call graph   Toon Verstraelen
• neither PGI nor Intel compiler working?   Ilya
  • [CP2K:2376] Re: neither PGI nor Intel compiler working?   Ondrej Marsalek
    • neither PGI nor Intel compiler working?   flo
      • [CP2K:2378] Re: neither PGI nor Intel compiler working?   Ondrej Marsalek
      • [CP2K:2378] Re: neither PGI nor Intel compiler working?   Ondrej Marsalek
• cp2k on CRAY-XT5 rosa   carlo antonio pignedoli
  • cp2k on CRAY-XT5 rosa   vweber
    • [CP2K:2383] Re: cp2k on CRAY-XT5 rosa   carlo antonio pignedoli
• Dipole intensities   obo
  • Dipole intensities   flo
• The Kohn Sham matrix is not 100% occupied   Claudio
  • The Kohn Sham matrix is not 100% occupied   mguidon
    • The Kohn Sham matrix is not 100% occupied   Claudio
      • The Kohn Sham matrix is not 100% occupied   Claudio
      • The Kohn Sham matrix is not 100% occupied   mguidon
      • The Kohn Sham matrix is not 100% occupied   Claudio
      • The Kohn Sham matrix is not 100% occupied   mguidon
      • The Kohn Sham matrix is not 100% occupied   Claudio
• Pseudooptimization?   Ilya
  • Pseudooptimization?   Ilya
  • [CP2K:2396] Pseudooptimization?   Teodoro Laino
    • Pseudooptimization?   Axel
      • Pseudooptimization?   Ilya
      • Pseudooptimization?   Axel
    • Pseudooptimization?   Ilya
• NaNs in wave function cube files   Claudio
  • NaNs in wave function cube files   Claudio
    • NaNs in wave function cube files   mguidon
      • NaNs in wave function cube files   Claudio
      • [CP2K:2408] Re: NaNs in wave function cube files   Laino Teodoro
    • NaNs in wave function cube files   Matthias Krack
      • NaNs in wave function cube files   Claudio
      • NaNs in wave function cube files   Matthias Krack
• Error cp_fm_cholesky in regtest   ambrosek
• negative homo - lumo gap   Claudio
  • negative homo - lumo gap   marci
• error in METADYN output   Liu
  • [CP2K:2415] error in METADYN output   Teodoro Laino
• Catastrophical Error w/ Intel Compiler and w/o libintwrapper   Frank Uhlig
  • Catastrophical Error w/ Intel Compiler and w/o libintwrapper   Matthias Krack
    • [CP2K:2418] Re: Catastrophical Error w/ Intel Compiler and w/o libintwrapper   Unknown
      • Catastrophical Error w/ Intel Compiler and w/o libintwrapper   Matthias Krack
      • Catastrophical Error w/ Intel Compiler and w/o libintwrapper   Frank Uhlig
      • Catastrophical Error w/ Intel Compiler and w/o libintwrapper   Matthias Krack
      • Catastrophical Error w/ Intel Compiler and w/o libintwrapper   Frank Uhlig
    • [CP2K:2418] Re: Catastrophical Error w/ Intel Compiler and w/o libintwrapper   Ondrej Marsalek
• QM/MM input   Caterina
  • [CP2K:2420] QM/MM input   Teodoro Laino
• Wannier centers and molecular dipoles   Ondrej Marsalek
  • Wannier centers and molecular dipoles   Frank Uhlig
  • [CP2K:2427] Wannier centers and molecular dipoles   Teodoro Laino

Last message date: Fri Nov 27 16:32:21 UTC 2009
Archived on: Thu Mar 3 11:47:26 UTC 2022

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