January 2018 Archives by thread

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Starting: Mon Jan 1 06:56:19 CET 2018
Ending: Wed Jan 31 17:21:55 CET 2018
Messages: 94

• [ase-users] hcp0001 surface of La2O3   Punit Kumar
  • [ase-users] hcp0001 surface of La2O3   Ask Hjorth Larsen
• [ase-users] ASE database encoding of Atoms data   Jens Jørgen Mortensen
• [ase-users] ase-users Digest, Vol 114, Issue 11   Ask Hjorth Larsen
  • [ase-users] ase-users Digest, Vol 114, Issue 11   fabian
    • [ase-users] ase-users Digest, Vol 114, Issue 11   Ask Hjorth Larsen
      • [ase-users] ase-users Digest, Vol 114, Issue 11   fabian
      • [ase-users] ase-users Digest, Vol 114, Issue 11   Ask Hjorth Larsen
• [ase-users] EMT-PES Script   Jens Jørgen Mortensen
• [ase-users] Structure Optimization in NEB via Vasp   Dennis Trujillo
• [ase-users] Structure Optimization in NEB via Vasp   Dennis Trujillo
• [ase-users] EMT-PES Script   Jens Jørgen Mortensen
• [ase-users] oxygen terminated la2o3 surface   Punit Kumar
  • [ase-users] oxygen terminated la2o3 surface   Ask Hjorth Larsen
    • [ase-users] oxygen terminated la2o3 surface   Punit Kumar
• [ase-users] ase-users Digest, Vol 115, Issue 4   Abid Channa
• [ase-users] Sorting the atoms by type is ASE Atoms object   Spencer Hills
• [ase-users] Sorting the atoms by type is ASE Atoms object   Spencer Hills
  • [ase-users] Sorting the atoms by type is ASE Atoms object   Ask Hjorth Larsen
    • [ase-users] Sorting the atoms by type is ASE Atoms object   Spencer Hills
• [ase-users] system_changes always indicates everything has changed   Ellad Tadmor
  • [ase-users] system_changes always indicates everything has changed   James Kermode
    • [ase-users] system_changes always indicates everything has changed   Ask Hjorth Larsen
• [ase-users] Problem Restarting Constrained Relaxation with Vasp Calculator   Eric Hermes
  • [ase-users] Problem Restarting Constrained Relaxation with Vasp Calculator   Andrew Rosen
• [ase-users] NEB Calculation   Abid Channa
  • [ase-users] NEB Calculation   Ask Hjorth Larsen
    • [ase-users] NEB Calculation   Abid Channa
      • [ase-users] NEB Calculation   Ask Hjorth Larsen
      • [ase-users] NEB Calculation   Abid Channa
      • [ase-users] NEB Calculation   Ask Hjorth Larsen
      • [ase-users] NEB Calculation   Abid Channa
• [ase-users] python3 encoding error?   Glenn Jones
  • [ase-users] python3 encoding error?   Jens Jørgen Mortensen
    • [ase-users] python3 encoding error?   Glenn Jones
    • [ase-users] python3 encoding error?   Glenn Jones
      • [ase-users] python3 encoding error?   Jens Jørgen Mortensen
• [ase-users] NEB Calculation   Ask Hjorth Larsen
  • [ase-users] NEB Calculation   Abid Channa
    • [ase-users] NEB Calculation   Ask Hjorth Larsen
      • [ase-users] NEB Calculation   Abid Channa
      • [ase-users] NEB Calculation   Ask Hjorth Larsen
      • [ase-users] NEB Calculation   Abid Channa
      • [ase-users] NEB Calculation   Ask Hjorth Larsen
• [ase-users] Upcoming release 3.16.0   Ask Hjorth Larsen
• [ase-users] Relax unit cell with strain   Protik Das
  • [ase-users] Relax unit cell with strain   James Kermode
    • [ase-users] Relax unit cell with strain   Protik Das
• [ase-users] Making orthorgonal 3x3x6 of Pt(111)   Kofi Oware Sarfo
  • [ase-users] Making orthorgonal 3x3x6 of Pt(111)   Eric Hermes
• [ase-users] Feature request: copy() method for a vasp calculator object   Protik Das
  • [ase-users] Feature request: copy() method for a vasp calculator object   Tom Daff
    • [ase-users] Feature request: copy() method for a vasp calculator object   Ask Hjorth Larsen
• [ase-users] Questions regarding the calculate() method   Kondov, Ivan (SCC)
  • [ase-users] Questions regarding the calculate() method   Ask Hjorth Larsen
    • [ase-users] Questions regarding the calculate() method   Kondov, Ivan (SCC)
      • [ase-users] Questions regarding the calculate() method   Ask Hjorth Larsen
• [ase-users] GULP calculator in ASE with periodic boundary conditions   James Aston
  • [ase-users] GULP calculator in ASE with periodic boundary conditions   Ask Hjorth Larsen
    • [ase-users] GULP calculator in ASE with periodic boundary conditions   James Aston
• [ase-users] tip3p and QMMM   daniele selli
  • [ase-users] tip3p and QMMM   Gianluca Levi
• [ase-users] There is one error while running the command ase test   Anant Ojha
  • [ase-users] There is one error while running the command ase test   Anant Ojha
  • [ase-users] There is one error while running the command ase test   Ask Hjorth Larsen
    • [ase-users] There is one error while running the command ase test   Anant Ojha
• [ase-users] GULP calculator in ASE with periodic boundary conditions   Ask Hjorth Larsen
• [ase-users] atoms.set_angles question   Andrew Rosen
  • [ase-users] atoms.set_angles question   Andrew Rosen
    • [ase-users] atoms.set_angles question   Jens Jørgen Mortensen
      • [ase-users] atoms.set_angles question   Andrew Rosen
• [ase-users] Calculating core-level shifts in one System and between different systems with VASP   fabian
  • [ase-users] Calculating core-level shifts in one System and between different systems with VASP   Melissa A. Hines
• [ase-users] vibration analysis with reaxff   Claudio A. Perottoni
• [ase-users] vibration analysis with reaxff   Avakyan L.A.
• [ase-users] Windows tests on AppVeyor   Jens Jørgen Mortensen
• [ase-users] Some glitches in ASE-3.15.x   Chang Liu
  • [ase-users] Some glitches in ASE-3.15.x   Chang Liu
    • [ase-users] Some glitches in ASE-3.15.x   Jens Jørgen Mortensen
      • [ase-users] Some glitches in ASE-3.15.x   Ask Hjorth Larsen
      • [ase-users] Some glitches in ASE-3.15.x   Jens Jørgen Mortensen
      • [ase-users] Some glitches in ASE-3.15.x   Chang Liu
      • [ase-users] Some glitches in ASE-3.15.x   Jens Jørgen Mortensen
      • [ase-users] Some glitches in ASE-3.15.x   Chang Liu
• [ase-users] No bin dir in tarball   Ask Hjorth Larsen
• [ase-users] Implementing our own calculator   Phani Motamarri
  • [ase-users] Implementing our own calculator   Ask Hjorth Larsen
• [ase-users] ase fails suddenly / No Menu in gui   fabian
• [ase-users] Installing ASE: Handling ase test errors   JOSHUA MATEO SALAZAR MEJIA
  • [ase-users] Installing ASE: Handling ase test errors   Jens Jørgen Mortensen
• [ase-users] Installing ASE: Handling ase test errors   Jens Jørgen Mortensen
• [ase-users] How to check if a POSCAR file has constraints?   fabian
  • [ase-users] How to check if a POSCAR file has constraints?   Duy Le
• [ase-users] Fluctuating forces-NEB   Divya Bohra - TNW

Last message date: Wed Jan 31 17:21:55 CET 2018
Archived on: Wed Jan 31 17:22:08 CET 2018

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