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Révision 1
ASE 3.4.1.1765
Fichiers
- ajouté
- modifié
- copié
- renommé
- supprimé
- PKG-INFO
- README.txt
- ase
- __init__.py
- all.py
- atom.py
- atoms.py
- calculators
- constraints.py
- data
- dft
- examples
- gui
- __init__.py
- ag.py
- bulk_modulus.py
- calculator.py
- constraints.py
- debug.py
- dft.py
- energyforces.py
- execute.py
- graphene.py
- graphs.py
- gtkexcepthook.py
- gui.py
- images.py
- languages
- minimize.py
- movie.py
- nanoparticle.py
- nanotube.py
- neb.py
- progress.py
- pybutton.py
- repeat.py
- rot_tools.py
- rotate.py
- scaling.py
- settings.py
- setupwindow.py
- simulation.py
- status.py
- surfaceslab.py
- view.py
- widgets.py
- infrared.py
- io
- lattice
- md
- neb.py
- old.py
- optimize
- parallel.py
- structure.py
- svnversion.py
- svnversion_io.py
- test
- Ag-Cu100.py
- CO2_Au111.py
- COCu111.py
- COCu111_2.py
- __init__.py
- atom.py
- bader.py
- basin.py
- build.py
- center.py
- coverage.py
- crystal.py
- dimer.py
- distmom.py
- emt.py
- emt1.py
- example.py
- exciting.py
- geometry.py
- h2.py
- hcp.py
- io.py
- jacapo.py
- magmom.py
- maxwellboltzmann.py
- md.py
- n2.py
- neb.py
- neighbor.py
- netcdf.py
- properties.py
- pull.py
- replay.py
- rotate.py
- rotate_euler.py
- scaled_positions.py
- stm.py
- strain.py
- things.py
- trajectory.py
- unitcellfilter.py
- vacancy.py
- vasp_Al_volrelax.py
- vasp_co.py
- verlet.py
- vib.py
- vtk_data.py
- vtk_pipeline.py
- thermochemistry.py
- transport
- units.py
- utils
- version.py
- vibrations.py
- visualize
- xrdebye.py
- setup.py
- tools