October 2024 Archives by thread

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Starting: Tue Oct 1 07:52:21 UTC 2024
Ending: Thu Oct 10 12:11:03 UTC 2024
Messages: 31

• [CP2K-user] [CP2K:20734] Adsorption of organic molecules on metal surface   Krack Matthias
• [CP2K-user] [CP2K:20736] Re: Polarizability calculation   Beliz Gökmen
• [CP2K-user] [CP2K:20737] 6-31+G(d) basis set? + anion questions   Michela Benazzi
• [CP2K-user] [CP2K:20738] Gallium + CO2 lack of convergence   Michela Benazzi
  • [CP2K-user] [CP2K:20740] Re: Gallium + CO2 lack of convergence   Marcella Iannuzzi
    • [CP2K-user] [CP2K:20741] Re: Gallium + CO2 lack of convergence   Michela Benazzi
      • [CP2K-user] [CP2K:20742] Re: Gallium + CO2 lack of convergence   Marcella Iannuzzi
      • [CP2K-user] [CP2K:20743] Re: Gallium + CO2 lack of convergence   Michela Benazzi
      • [CP2K-user] [CP2K:20744] Re: Gallium + CO2 lack of convergence   Marcella Iannuzzi
• [CP2K-user] [CP2K:20739] Setting up time dependent MM partial charges   mayank... at gmail.com
• [CP2K-user] [CP2K:20745] Re: cp2k V_XC_CUBE   Lukas C
• [CP2K-user] [CP2K:20745] cp2k Hybrids + Smearing   Angus Gentles
  • [CP2K-user] [CP2K:20746] cp2k Hybrids + Smearing   Jürg Hutter
• [CP2K-user] [CP2K:20747] Optimization of Bulk and slab   Hanaa Sari
  • [CP2K-user] [CP2K:20749] Optimization of Bulk and slab   Krack Matthias
    • [CP2K-user] [CP2K:20751] Optimization of Bulk and slab   Hanaa Sari
• [CP2K-user] [CP2K:20748] start with CP2k   Shivam Gupta
• [CP2K-user] [CP2K:20750] slow slurm regtests   bartosz mazur
  • [CP2K-user] [CP2K:20760] Re: slow slurm regtests   Johann Pototschnig
• [CP2K-user] [CP2K:20752] about molden file for MO visualization   xuan wang
• [CP2K-user] [CP2K:20753] compilation problems - LHS and RHS of an assignment statement have incompatible types   bartosz mazur
  • [CP2K-user] [CP2K:20755] Re: compilation problems - LHS and RHS of an assignment statement have incompatible types   Frederick Stein
    • [CP2K-user] [CP2K:20756] Re: compilation problems - LHS and RHS of an assignment statement have incompatible types   bartosz mazur
      • [CP2K-user] [CP2K:20759] Re: compilation problems - LHS and RHS of an assignment statement have incompatible types   Frederick Stein
• [CP2K-user] [CP2K:20756] Inconsistent geometry optimisations   'daniel Storm' via cp2k
  • [CP2K-user] [CP2K:20757] Inconsistent geometry optimisations   Krack Matthias
    • [CP2K-user] [CP2K:20762] Inconsistent geometry optimisations   'daniel Storm' via cp2k
• [CP2K-user] [CP2K:20760] Dipole of PIMD in CP2K   sh X
• [CP2K-user] [CP2K:20763] Cytotec in Kuwait 00201026560416 | Abortion pills Kuwait at a price of 145 Kuwaiti dinars   سايتوتك 200
• [CP2K-user] [CP2K:20762] Segmentation Fault (SIGSEGV) when Using RESP in Geometry Optimization   Souvik Mondal
• [CP2K-user] [CP2K:20764] Re: Segmentation fault with Hirshfeld CDFT   uca... at ucl.ac.uk

Last message date: Thu Oct 10 12:11:03 UTC 2024
Archived on: Thu Oct 10 12:11:09 UTC 2024

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