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Overwriting ASE Calculator Results and Saving Results to a Trajectory File
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3
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776
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May 10, 2025
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Layer creation problem in ASE
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4
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146
|
April 29, 2025
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ase.io.cif.read_cif error
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0
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56
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April 14, 2025
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Running classical MD simulation with ASE
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0
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56
|
April 13, 2025
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Typo of Inhomogenous_NPTBerendsen
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0
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38
|
March 13, 2025
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ASE read/write lammps-data
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0
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344
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March 11, 2025
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Parallelise MACE calculator
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5
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1044
|
February 26, 2025
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Minima Hopping with Vasp, error in MD initiation
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1
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177
|
February 19, 2025
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Quantum Espresso command line in updated versions of ASE.
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0
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93
|
January 10, 2025
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Imaginary rotational and translational modes
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1
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75
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January 2, 2025
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Read extxyz in ase v. 3.23.0
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5
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758
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December 18, 2024
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Using Phonons.run after single-point calculation in Quantum Espresso - PropertyNotImplemented Error
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3
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150
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December 11, 2024
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ASE+ALAMODE for structure optimization
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2
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83
|
December 9, 2024
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`AssertionError` in `LAMMPSlib` with ASE during Potential Energy Calculation
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0
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59
|
December 6, 2024
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Error using the lammpsrun calculator in the Python ASE module
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6
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196
|
December 5, 2024
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ASE fails to construct neighbourlist
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0
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39
|
November 29, 2024
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ASE phonon calculations
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1
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239
|
November 16, 2024
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Read atomic positions from QE MD output
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0
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87
|
November 15, 2024
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How to write a standard MACE-type XYZ file by ASE
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1
|
145
|
November 7, 2024
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Dealing with .xtc files in ASE
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1
|
109
|
November 4, 2024
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Value of `delta` in the Vibrations class
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1
|
57
|
November 4, 2024
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Ase.contrain gives error indices has wrong amount of dimensions
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0
|
52
|
October 27, 2024
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Issues with ASE-GUI with MacOS in dark mode
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|
5
|
144
|
October 20, 2024
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How to apply strains to entire cell?
|
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0
|
72
|
October 9, 2024
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NPT dyn for NVT Nose-hoover thermostat fixed volume
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0
|
122
|
October 9, 2024
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Ase test : ERROR collecting test_imports.py
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0
|
78
|
October 3, 2024
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Fixing the Center of Mass for CSVR thermostat
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0
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58
|
October 2, 2024
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GPAW issue in ASE
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1
|
60
|
September 25, 2024
|
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OpenMPI problem with ase test
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2
|
86
|
September 21, 2024
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Changing axes colors of default ASE viewer
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|
4
|
97
|
September 21, 2024
|