January 2012 Archives by thread

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Starting: Tue Jan 3 20:11:56 UTC 2012
Ending: Fri Jan 27 08:31:14 UTC 2012
Messages: 40

• Restart Files   DEC014
  • Restart Files   flo
• 1D MTD   Ross, Sun
• Dipole moment from Berry phase   Ali
• Units of Morse potential   Matt W
• thermodynamic info   mottarello
• How to Print Out Wannier Hamiltonian   Dr Ling Ge
  • [CP2K:3694] How to Print Out Wannier Hamiltonian   Alin M Elena
• Lagrange polynomials in CP2K?   Hanning Chen
• COMETS 2012 - 3rd IEEE Track on Collaborative Modeling and Simulation - Call for Papers   daniele
• vdw and scf convergence   Jun
  • vdw and scf convergence   Matt W
    • vdw and scf convergence   Jun
      • vdw and scf convergence   Jun
      • 回复： [CP2K:3701] Re: vdw and scf convergence   shoutian sun
      • Re: 回复： [CP2K:3701] Re: vdw and scf convergence   Jun
      • Re: 回复： [CP2K:3701] Re: vdw and scf convergence   Jun
      • 回复： 回复： [CP2K:3706] Re: vdw and scf convergence   shoutian sun
• hwloc support in cp2k-trunk   Axel
  • [CP2K:3705] hwloc support in cp2k-trunk   Christiane Pousa
    • [CP2K:3705] hwloc support in cp2k-trunk   Axel
      • [CP2K:3713] hwloc support in cp2k-trunk   Christiane Pousa
      • [CP2K:3713] hwloc support in cp2k-trunk   Axel
      • [CP2K:3726] hwloc support in cp2k-trunk   Christiane Pousa
• Bug in CELL_OPT with MD??   Joseph Han
• vibrational analysis from MD   mottarello
• linear solver Subroutine for sparse matrices in DBCSR format   Hanning Chen
  • [CP2K:3710] linear solver Subroutine for sparse matrices in DBCSR format   hut... at pci.uzh.ch
• why energies the same?   Chetan Mahajan
  • [CP2K:3713] why energies the same?   Teodoro Laino
    • [CP2K:3714] why energies the same?   Chetan Mahajan
• Few questions from a beginner   Chetan Mahajan
  • Few questions from a beginner   Axel
    • [CP2K:3718] Re: Few questions from a beginner   Chetan Mahajan
• running on cores more than number of atoms   Chetan Mahajan
  • running on cores more than number of atoms   Matt W
  • running on cores more than number of atoms   Axel
    • [CP2K:3725] Re: running on cores more than number of atoms   Chetan Mahajan
• Memory Issue QMMM Cray XE6   marco.stenta
  • [CP2K:3722] Memory Issue QMMM Cray XE6   Teodoro Laino

Last message date: Fri Jan 27 08:31:14 UTC 2012
Archived on: Thu Mar 3 11:47:29 UTC 2022

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