December 2020 Archives by date

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Starting: Tue Dec 8 21:49:59 CET 2020
Ending: Thu Dec 31 20:08:32 CET 2020
Messages: 55

• [ase-users] ase test fail   rashid al-heidous
• [ase-users] ase test fail   Jakob Schiøtz
• [ase-users] ase test fail   Ask Hjorth Larsen
• [ase-users] ase test fail   rashid al-heidous
• [ase-users] What is the command to write extended XYZ file?   Dong gi Kang
• [ase-users] Finding a permutation between two Atoms   Michael Lamparski
• [ase-users] What is the command to write extended XYZ file?   James Kermode
• [ase-users] Save results of dynamic simulation of atoms position, energy, forces   Dong gi Kang
• [ase-users] Save results of dynamic simulation of atoms position, energy, forces   james.kermode at gmail.com
• [ase-users] Save results of dynamic simulation of atoms position, energy, forces   Dong gi Kang
• [ase-users] Save results of dynamic simulation of atoms position, energy, forces   james.kermode at gmail.com
• [ase-users] About SinglePointCalculator command...?   Dong gi Kang
• [ase-users] About SinglePointCalculator command...?   Michael Joseph Waters
• [ase-users] About SinglePointCalculator command...?   Dong gi Kang
• [ase-users] About SinglePointCalculator command...?   Michael Joseph Waters
• [ase-users] neighborlist: two atoms with distance larger than cutoff identified as neighbors   Chunguang Tang
• [ase-users] neighborlist: two atoms with distance larger than cutoff identified as neighbors   Tristan Maxson
• [ase-users] neighborlist: two atoms with distance larger than cutoff identified as neighbors   Ask Hjorth Larsen
• [ase-users] neighborlist: two atoms with distance larger than cutoff identified as neighbors   Chunguang Tang
• [ase-users] Genetic algorithm- new structures   Mina Taleblou
• [ase-users] Genetic algorithm- new structures   Steen Lysgaard
• [ase-users] Administrative message: Migration of listserv.fysik.dtu.dk on December 15   Ole Holm Nielsen
• [ase-users] Genetic algorithm- new structures   Mina Taleblou
• [ase-users] Genetic algorithm- new structures   Mina Taleblou
• [ase-users] Administrative message: Migration of listserv.fysik.dtu.dk on December 15   Ole Holm Nielsen
• [ase-users] Error message: when LAMMPS imported from ase.calculators.lammpsrun   Dong gi Kang
• [ase-users] Error message: when LAMMPS imported from ase.calculators.lammpsrun   Albert Bruix Fusté
• [ase-users] Error message: when LAMMPS imported from ase.calculators.lammpsrun   Dong gi Kang
• [ase-users] Error message: when LAMMPS imported from ase.calculators.lammpsrun   Dong gi Kang
• [ase-users] Using lammps to calculate (ZnO)1 nanocluster   Dong gi Kang
• [ase-users] Beer/coffee on Thursday 21:00 CET (virtual meeting)   Ask Hjorth Larsen
• [ase-users] MD simulation with NPT   Shi Li
• [ase-users] FHI-aims cartesian rather than fractional position   Dong gi Kang
• [ase-users] Beer/coffee on Thursday 21:00 CET (virtual meeting)   Ask Hjorth Larsen
• [ase-users] ASE-QE run issue   Punit Kumar
• [ase-users] ASE-QE run issue   Albert Bruix Fusté
• [ase-users] Save "forces" from GULP/QuasiNewton   Dong gi Kang
• [ase-users] ASE-QE run issue   Punit Kumar
• [ase-users] ASE-QE run issue   Ask Hjorth Larsen
• [ase-users] ASE-QE run issue   Punit Kumar
• [ase-users] ASE-QE run issue   Ask Hjorth Larsen
• [ase-users] ASE-QE run issue   Punit Kumar
• [ase-users] MD simulation with NPT   Gaël Donval
• [ase-users] ase.Atoms set_initial_charges() issue   Noel Jakse
• [ase-users] ase.Atoms set_initial_charges() issue   Ask Hjorth Larsen
• [ase-users] Fw: MD simulation with NPT   Gaël Donval
• [ase-users] ase test fails: imp module is deprecated   Simon Beyer
• [ase-users] ase test fails: imp module is deprecated   gdonval at pm.me
• [ase-users] failture when testing ase   Xiaobo Chen
• [ase-users] failture when testing ase   Xiaobo Chen
• [ase-users] failture when testing ase   Gaël Donval
• [ase-users] ase.Atoms set_initial_charges() issue   Noel Jakse
• [ase-users] ase.io.read of v3.20 and v3.21b show different behavious with the attached cif files   刘晓彤
• [ase-users] ase.io.read of v3.20 and v3.21b show different behavious with the attached cif files   Gaël Donval
• [ase-users] ase.io.read of v3.20 and v3.21b show different behavious with the attached cif files   Gaël Donval

Last message date: Thu Dec 31 20:08:32 CET 2020
Archived on: Thu Dec 31 20:09:27 CET 2020

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