January 2026 Archives by thread

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Starting: Fri Jan 2 00:05:33 UTC 2026
Ending: Mon Jan 19 14:42:12 UTC 2026
Messages: 35

• [CP2K-user] [CP2K:22015] Python ase-CP2K communication stalls   Ioachim Dusa
  • [CP2K-user] [CP2K:22017] Re: Python ase-CP2K communication stalls   Ioachim Dusa
    • [CP2K-user] [CP2K:22022] Re: Python ase-CP2K communication stalls   Ioachim Dusa
• [CP2K-user] [CP2K:22016] Transition state calculation error   Jumana Ishrat
• [CP2K-user] [CP2K:22018] Sensitivity of SCCS convergence to RHO_MIN / RHO_MAX and Poisson solver choice   Mridhula
• [CP2K-user] [CP2K:22019] Facing issue while doing geometry optimization   Kaustubh Pathak
  • [CP2K-user] [CP2K:22022] Re: Facing issue while doing geometry optimization   Frederick Stein
• [CP2K-user] [CP2K:22021] Re: Issue with EPS_DEFAULT Sensitivity: Why Does 1.0E-12 Cause CPASSERT Failure?   Frederick Stein
  • [CP2K-user] [CP2K:22026] Re: Issue with EPS_DEFAULT Sensitivity: Why Does 1.0E-12 Cause CPASSERT Failure?   yis... at 163.com
    • [CP2K-user] [CP2K:22028] Re: Issue with EPS_DEFAULT Sensitivity: Why Does 1.0E-12 Cause CPASSERT Failure?   Frederick Stein
      • [CP2K-user] [CP2K:22030] Re: Issue with EPS_DEFAULT Sensitivity: Why Does 1.0E-12 Cause CPASSERT Failure?   yis... at 163.com
      • [CP2K-user] [CP2K:22031] Re: Issue with EPS_DEFAULT Sensitivity: Why Does 1.0E-12 Cause CPASSERT Failure?   Frederick Stein
      • [CP2K-user] [CP2K:22033] Re: Issue with EPS_DEFAULT Sensitivity: Why Does 1.0E-12 Cause CPASSERT Failure?   yis... at 163.com
      • [CP2K-user] [CP2K:22034] Re: Issue with EPS_DEFAULT Sensitivity: Why Does 1.0E-12 Cause CPASSERT Failure?   yis... at 163.com
      • [CP2K-user] [CP2K:22036] Re: Issue with EPS_DEFAULT Sensitivity: Why Does 1.0E-12 Cause CPASSERT Failure?   Frederick Stein
      • [CP2K-user] [CP2K:22039] Re: Issue with EPS_DEFAULT Sensitivity: Why Does 1.0E-12 Cause CPASSERT Failure?   Frederick Stein
      • [CP2K-user] [CP2K:22042] Re: Issue with EPS_DEFAULT Sensitivity: Why Does 1.0E-12 Cause CPASSERT Failure?   yis... at 163.com
      • [CP2K-user] [CP2K:22043] Re: Issue with EPS_DEFAULT Sensitivity: Why Does 1.0E-12 Cause CPASSERT Failure?   Frederick Stein
      • [CP2K-user] [CP2K:22044] Re: Issue with EPS_DEFAULT Sensitivity: Why Does 1.0E-12 Cause CPASSERT Failure?   yis... at 163.com
      • [CP2K-user] [CP2K:22045] Re: Issue with EPS_DEFAULT Sensitivity: Why Does 1.0E-12 Cause CPASSERT Failure?   Frederick Stein
• [CP2K-user] [CP2K:22023] Restart File Problem   Satchith PS
  • [CP2K-user] [CP2K:22031] Re: Restart File Problem   Michael LaCount
• [CP2K-user] [CP2K:22025] CP2K version 2026.1 released   Ole Schütt
  • [CP2K-user] [CP2K:22026] CP2K version 2026.1 released   Victor Volkov
    • [CP2K-user] [CP2K:22029] CP2K version 2026.1 released   Dmitry Ryndyk
• [CP2K-user] [CP2K:22034] Problem with cp2k in vmware   m1racle
• [CP2K-user] [CP2K:22036] CP2K build with GPU support fails   Vijay Mocherla
  • [CP2K-user] [CP2K:22041] Re: CP2K build with GPU support fails   Johann Pototschnig
• [CP2K-user] [CP2K:22038] Rotational modes of methanol have high frequencies (> 550 cm-1), and they do not look like rotations   Torstein Fjermestad
  • [CP2K-user] [CP2K:22039] Rotational modes of methanol have high frequencies (> 550 cm-1), and they do not look like rotations   Jürg Hutter
• [CP2K-user] [CP2K:22046] Reminder: CECAM+Psi-k School "Hybrid Quantum Mechanics / Molecular Mechanics (QM/MM) Approaches to Biochemistry and Beyond", Lausanne, March 23rd to 27th, 2026   Ari Paavo Seitsonen (apsi)
• [CP2K-user] [CP2K:22046] libyaml-cpp-pace.a not found --> can't install ACE   DazlerNL
• [CP2K-user] [CP2K:22048] Chunk regions for printing temperature gradiant   Somayeh Ahmadkhani
• [CP2K-user] [CP2K:22049] CP2K made simple   Frederick Stein
• [CP2K-user] [CP2K:22050] ESP charge visualization   Andreas Döll

Last message date: Mon Jan 19 14:42:12 UTC 2026
Archived on: Mon Jan 19 14:42:19 UTC 2026

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