January 2020 Archives by date
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] 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?
Asmus Ougaard Dohn
- [ase-users] ORCA-calculator for ASE?
Ask Hjorth Larsen
- [ase-users] A short script for making a periodic table
Michael Joseph Waters
- [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] 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] Major updates to testing: pytest, dockers
Adam Jackson
- [ase-users] Dimer
Michael Joseph Waters
- [ase-users] Dimer convergence
Alaithan, Zainab
- [ase-users] Save SocketIOCalculator property to file
Offermans Willem
- [ase-users] [EXTERNAL] Dimer convergence
Hermes, Eric
- [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] Dimer convergence
Michael Joseph Waters
- [ase-users] Save SocketIOCalculator property to file
Ask Hjorth Larsen
- [ase-users] Save SocketIOCalculator property to file
Offermans Willem
- [ase-users] Creating a periodic Na3Bi (100) structure.
Vasilios Passias
- [ase-users] Dimer method
Alaithan, Zainab
- [ase-users] A short script for making a periodic table
Jens Jørgen Mortensen
- [ase-users] Export to CAD files?
Thomas Aarholt
- [ase-users] Export to CAD files?
Adam Jackson
- [ase-users] Creating a periodic Na3Bi (100) structure.
Punit Kumar
- [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] How to create sqrt surfaces
Punit Kumar
- [ase-users] Creating a periodic Na3Bi (100) structure.
Ask Hjorth Larsen
- [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] 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] Dimer
Michael Joseph Waters
- [ase-users] energies are lost when switch on remove_rotation_and_translation in NEB
Ask Hjorth Larsen
- [ase-users] thermochem
Ask Hjorth Larsen
- [ase-users] thermochem
Eugenio Furtado
- [ase-users] Dimer
Alaithan, Zainab
- [ase-users] Dimer
Michael Joseph Waters
- [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] 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] 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] openmx error
Reza Behjatmanesh-Ardakani
- [ase-users] K-points error in openmx
Reza Behjatmanesh-Ardakani
- [ase-users] openmx error
Reza Behjatmanesh-Ardakani
- [ase-users] (2x1)-Reconstruction of Si(100) surface
Abid Channa
- [ase-users] openmx error
Ask Hjorth Larsen
- [ase-users] openmx error
Ask Hjorth Larsen
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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