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Issues list

Wrong Voronoi volume for hcp atoms bug Something isn't working
#1630 opened Dec 17, 2024 by usaikia
@jan-janssen @srmnitc
Calphy crash in collect with n_print_steps!=0 bug Something isn't working
#1616 opened Dec 2, 2024 by pmrv
@srmnitc
create.structure.ase.read fails for trajectories bug Something isn't working
#1604 opened Nov 18, 2024 by niklassiemer
How to load jobs which finished in old kernel (pyiron/old latest Python3.10) in new kernel (pyiron/old latest Python3.11) bug Something isn't working
#1585 opened Oct 14, 2024 by lfzhu-phys
2
get_resolved_dos() Inconsistent Behavior with atom_indices Type bug Something isn't working
#1584 opened Oct 11, 2024 by yuyuanjingxuan
Can't use off-diagonal pressures with non-triclinic boxes. bug Something isn't working
#1580 opened Oct 6, 2024 by pmrv
2
CI conda setup allows defaults bug Something isn't working
#1544 opened Aug 26, 2024 by liamhuber
Cell (along with other properties) cannot be accessed from project_hdf5 in Sphinx bug Something isn't working major incompatible API changes
#1508 opened Jul 26, 2024 by samwaseda
2
Pyiron read_cube_file() does not work for certain formats of cube files. bug Something isn't working
#1425 opened May 24, 2024 by sam-mattoso
job crashes early in hdfio bug Something isn't working
#1422 opened May 21, 2024 by freyso
@skatnagallu
10
Phonopy and magmom bug Something isn't working
#1392 opened Apr 17, 2024 by Leimeroth
1
get_structure() for sphinx jobs gives error bug Something isn't working
#1378 opened Apr 12, 2024 by skatnagallu
1
@samwaseda @skatnagallu
6
Use input structure for get_number_of_species bug Something isn't working
#1350 opened Mar 1, 2024 by pmrv • Draft
3
Indexing Atoms broken on __getitem__ bug Something isn't working
#1343 opened Feb 26, 2024 by pmrv
@pmrv
3
Lammps input impossible to subclass nicely bug Something isn't working
#1336 opened Feb 22, 2024 by pmrv
1
LAMMPS interactive indicies bug bug Something isn't working
#1260 opened Dec 13, 2023 by jan-janssen
[Pre-bug/Awareness] Vasp changed POSCAR, added "/" after species specification bug Something isn't working
#1232 opened Nov 30, 2023 by ligerzero-ai
1
Vasprun parser doesn't parse everything that is intended bug Something isn't working
#1226 opened Nov 29, 2023 by pmrv
1
sphinx eigenvalue parser problem fix (again) bug Something isn't working
#1208 opened Nov 14, 2023 by ahmedabdelkawy
@samwaseda @freyso
2
No JTH potential for Si bug Something isn't working
#1202 opened Nov 9, 2023 by samwaseda
@samwaseda
27
Inconsistent Free Energy Calculation with D3 Correction in pyiron HDF5 Files bug Something isn't working
#1193 opened Oct 23, 2023 by yuyuanjingxuan
2
Interactive LAMMPS has the wrong working directory bug Something isn't working
#1165 opened Sep 15, 2023 by jan-janssen
Murnaghan: Round children names bug Something isn't working enhancement New feature or request integration Start the notebook integration tests for this PR
#1121 opened Jul 25, 2023 by pmrv • Draft
9
LAMMPS job scripts require a date attached to them bug Something isn't working
#1101 opened Jul 3, 2023 by ligerzero-ai
4
Vasp stresses are confusing and unit is a mystery bug Something isn't working
#1071 opened May 30, 2023 by Leimeroth
2
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