January 2020 Archives by thread

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Starting: Tue Jan 7 18:05:52 CET 2020
Ending: Tue Jan 28 18:05:51 CET 2020
Messages: 72

• [ase-users] ORCA-calculator for ASE?   Asmus Ougaard Dohn
  • [ase-users] ORCA-calculator for ASE?   Ask Hjorth Larsen
    • [ase-users] ORCA-calculator for ASE?   Asmus Ougaard Dohn
      • [ase-users] ORCA-calculator for ASE?   Ask Hjorth Larsen
      • [ase-users] ORCA-calculator for ASE?   Asmus Ougaard Dohn
• [ase-users] SocketIOCalculator i.c.w. NEB   Offermans Willem
  • [ase-users] SocketIOCalculator i.c.w. NEB   Ask Hjorth Larsen
    • [ase-users] SocketIOCalculator i.c.w. NEB   Offermans Willem
      • [ase-users] SocketIOCalculator i.c.w. NEB   Ask Hjorth Larsen
• [ase-users] ORCA-calculator for ASE?   Ask Hjorth Larsen
• [ase-users] A short script for making a periodic table   Michael Joseph Waters
  • [ase-users] A short script for making a periodic table   Jens Jørgen Mortensen
    • [ase-users] A short script for making a periodic table   Michael Joseph Waters
    • [ase-users] A short script for making a periodic table   Ask Hjorth Larsen
• [ase-users] The Dimer method   Alaithan, Zainab
  • [ase-users] The Dimer method   Michael Joseph Waters
• [ase-users] energies are lost when switch on remove_rotation_and_translation in NEB   GENG SUN
  • [ase-users] energies are lost when switch on remove_rotation_and_translation in NEB   Ask Hjorth Larsen
    • [ase-users] energies are lost when switch on remove_rotation_and_translation in NEB   GENG SUN
    • [ase-users] energies are lost when switch on remove_rotation_and_translation in NEB   Michael Joseph Waters
      • [ase-users] energies are lost when switch on remove_rotation_and_translation in NEB   Ask Hjorth Larsen
• [ase-users] Major updates to testing: pytest, dockers   Ask Hjorth Larsen
  • [ase-users] Major updates to testing: pytest, dockers   Jakob Schiøtz
    • [ase-users] Major updates to testing: pytest, dockers   Ask Hjorth Larsen
      • [ase-users] Major updates to testing: pytest, dockers   Ask Hjorth Larsen
• [ase-users] Printing Pressure or Stress from NpT MD Trajectory   Danjo De Chavez
• [ase-users] Dimer   Alaithan, Zainab
  • [ase-users] Dimer   Michael Joseph Waters
• [ase-users] Major updates to testing: pytest, dockers   Adam Jackson
• [ase-users] Dimer convergence   Alaithan, Zainab
  • [ase-users] [EXTERNAL] Dimer convergence   Hermes, Eric
  • [ase-users] Dimer convergence   Michael Joseph Waters
• [ase-users] Save SocketIOCalculator property to file   Offermans Willem
  • [ase-users] Save SocketIOCalculator property to file   Offermans Willem
    • [ase-users] Save SocketIOCalculator property to file   Ask Hjorth Larsen
      • [ase-users] Save SocketIOCalculator property to file   Offermans Willem
• [ase-users] resonant raman   Jay Wai
• [ase-users] Save SocketIOCalculator property to file   Maxime Van den Bossche
  • [ase-users] Save SocketIOCalculator property to file   Offermans Willem
    • [ase-users] Save SocketIOCalculator property to file   Offermans Willem
• [ase-users] Creating a periodic Na3Bi (100) structure.   Vasilios Passias
  • [ase-users] Creating a periodic Na3Bi (100) structure.   Punit Kumar
    • [ase-users] Creating a periodic Na3Bi (100) structure.   Ask Hjorth Larsen
• [ase-users] Dimer method   Alaithan, Zainab
• [ase-users] Export to CAD files?   Thomas Aarholt
• [ase-users] Export to CAD files?   Adam Jackson
• [ase-users] How to create sqrt surfaces   Punit Kumar
  • [ase-users] How to create sqrt surfaces   Jens Jørgen Mortensen
• [ase-users] Dimer   Alaithan, Zainab
  • [ase-users] Dimer   Michael Joseph Waters
    • [ase-users] Dimer   Offermans Willem
      • [ase-users] Dimer   Michael Joseph Waters
      • [ase-users] Dimer   Alaithan, Zainab
      • [ase-users] Dimer   Michael Joseph Waters
      • [ase-users] Dimer   Alaithan, Zainab
      • [ase-users] Dimer   Michael Joseph Waters
• [ase-users] thermochem   Eugenio Furtado
  • [ase-users] thermochem   Ask Hjorth Larsen
• [ase-users] rotate atoms to minimize the surrounding cuboid volume   GENG SUN
  • [ase-users] rotate atoms to minimize the surrounding cuboid volume   Ask Hjorth Larsen
    • [ase-users] rotate atoms to minimize the surrounding cuboid volume   David Ollodart
      • [ase-users] rotate atoms to minimize the surrounding cuboid volume   GENG SUN
      • [ase-users] rotate atoms to minimize the surrounding cuboid volume   Michael Joseph Waters
• [ase-users] Phase diagram: only_show_simplices   Adam Carlsson
• [ase-users] Error in openmx calculations   Reza Behjatmanesh-Ardakani
• [ase-users] ASE-openmx error   Reza Behjatmanesh-Ardakani
• [ase-users] openmx error   Reza Behjatmanesh-Ardakani
  • [ase-users] openmx error   Reza Behjatmanesh-Ardakani
    • [ase-users] openmx error   Ask Hjorth Larsen
      • [ase-users] openmx error   Ask Hjorth Larsen
• [ase-users] K-points error in openmx   Reza Behjatmanesh-Ardakani
• [ase-users] (2x1)-Reconstruction of Si(100) surface   Abid Channa

Last message date: Tue Jan 28 18:05:51 CET 2020
Archived on: Tue Jan 28 21:33:08 CET 2020

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