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Issues list

Do we actually need the AbstractSystem type? question Further information is requested
#125 opened Oct 23, 2024 by rkurchin
3
add positions_relative or similar? question Further information is requested
#124 opened Oct 23, 2024 by rkurchin
8
canonical implementation question Further information is requested
#123 opened Oct 23, 2024 by rkurchin
5
Atom namespace clash with Molly
#120 opened Oct 14, 2024 by rkurchin
1
FlexibleSystem should deprecate :atomic_mass
#111 opened Sep 2, 2024 by cortner
Should atomic_symbol return Symbol or ChemicalSpecies ?
#110 opened Sep 2, 2024 by cortner
2
Ascii and visualisation
#108 opened Aug 27, 2024 by mfherbst
2 tasks
1
subsystem function?
#95 opened Apr 9, 2024 by rkurchin
visualize_ascii on unit test case is broken bug Something isn't working
#92 opened Jan 16, 2024 by rkurchin
2
Consider extending == on Atom, FlexibleSystem with StructEquality.jl?
#89 opened Oct 18, 2023 by singularitti
11
Adding support for bonds
#87 opened Oct 2, 2023 by ejmeitz
31
Display is too rich as default
#83 opened Sep 21, 2023 by cortner
8
Utility to access optional AtomsBase keys (e.g. charge)
#78 opened Jul 3, 2023 by ejmeitz
2
Export optional system and atoms property keys and their units
#65 opened Feb 1, 2023 by mfherbst
Convenient functions for extending / dropping dimensions
#59 opened Dec 17, 2022 by mfherbst
FlexibleSystem is missing a propertynames implementation
#57 opened Oct 19, 2022 by mfherbst
1
add_atom/remove_atom functions, example with mutability?
#51 opened Aug 4, 2022 by rkurchin
2
Library of examples documentation Improvements or additions to documentation
#50 opened Aug 4, 2022 by rkurchin
1
Visualizing molecules and simulations
#48 opened Jun 5, 2022 by chemicalfiend
4
Generating bicrystals using CSL for bounding box
#44 opened Mar 28, 2022 by stefanbringuier
2
Supporting "arbitrary" properties
#43 opened Mar 26, 2022 by rkurchin
32
should there be a distance method? enhancement New feature or request question Further information is requested
#35 opened Jan 3, 2022 by rkurchin
2
make sure AtomsBase plays nice with Crystalline.jl/Bravais.jl
#31 opened Dec 15, 2021 by rkurchin
4
Should we add mass and momentum functions? question Further information is requested
#28 opened Nov 17, 2021 by rkurchin
1
Improve convenience constructors for included implementations enhancement New feature or request
#27 opened Nov 17, 2021 by rkurchin
1
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