issues
search
pyiron
/
pyiron_potentialfit
Fitting machine learning interatomic potentials with pyiron
http://potentials.rub.de
BSD 3-Clause "New" or "Revised" License
3
stars
1
forks
source link
issues
Newest
Newest
Most commented
Recently updated
Oldest
Least commented
Least recently updated
Bump pyiron-atomistics from 0.6.10 to 0.6.13
#150
dependabot[bot]
opened
2 days ago
1
Bump pyiron-base from 0.9.11 to 0.10.2
#149
dependabot[bot]
opened
1 week ago
1
Bump pyiron-atomistics from 0.6.10 to 0.6.12
#148
dependabot[bot]
closed
2 days ago
2
Bump pyiron-base from 0.9.11 to 0.10.1
#147
dependabot[bot]
closed
1 week ago
2
Bump numpy from 1.26.4 to 2.1.1
#146
dependabot[bot]
opened
3 weeks ago
1
Bump scipy from 1.14.0 to 1.14.1
#145
dependabot[bot]
opened
1 month ago
1
Bump pyiron-base from 0.9.11 to 0.10.0
#144
dependabot[bot]
closed
3 weeks ago
2
Bump pyiron-atomistics from 0.6.10 to 0.6.11
#143
dependabot[bot]
closed
3 weeks ago
2
ASSYST: Small fixes for collinear data
#142
pmrv
closed
1 month ago
2
ASSYST: very small strains may confuse VASP even if ISYM=-1
#141
pmrv
opened
1 month ago
0
Overwrote compress function to exclude 'output_potential.yace'
#140
HaithamGaafer
opened
1 month ago
2
Compress Pacemaker jobs
#139
jan-janssen
closed
1 month ago
2
Update pyxtal in env files
#138
pmrv
closed
1 month ago
2
Update pyxtal requirement from <0.7,>=0.6.0 to >=0.6.0,<1.1
#137
dependabot[bot]
closed
1 month ago
3
Bump pyiron-base from 0.9.11 to 0.9.12
#136
dependabot[bot]
closed
1 month ago
2
Bump numpy from 1.26.4 to 2.1.0
#135
dependabot[bot]
closed
3 weeks ago
2
Fix duplicate and inconsistant base/atomistics
#134
pmrv
closed
1 month ago
2
Bump matplotlib from 3.8.4 to 3.9.2
#133
dependabot[bot]
closed
1 month ago
2
Bump pyiron-base from 0.9.10 to 0.9.12
#132
dependabot[bot]
closed
1 month ago
1
Update pyiron-snippets requirement from <=0.1.3,>=0.1.1 to >=0.1.1,<=0.1.4
#131
dependabot[bot]
closed
1 month ago
3
Bump matplotlib from 3.8.4 to 3.9.1.post1
#130
dependabot[bot]
closed
1 month ago
3
More changes wrt to magnetic ASSYST
#129
pmrv
closed
1 month ago
1
Bump pyiron-contrib from 0.1.16 to 0.1.18
#128
dependabot[bot]
closed
1 month ago
1
Bump pyiron-atomistics from 0.6.4 to 0.6.10
#127
dependabot[bot]
closed
1 month ago
3
Bump pyiron-base from 0.9.10 to 0.9.11
#126
dependabot[bot]
closed
1 month ago
2
Update Notebooks
#125
pmrv
closed
2 months ago
2
Start renaming spgfit to Assyst again
#124
pmrv
closed
2 months ago
2
Bump snippets
#123
pmrv
closed
2 months ago
1
Start renaming spgfit to Assyst
#122
pmrv
closed
2 months ago
2
Bump pyiron-atomistics from 0.6.4 to 0.6.9
#121
dependabot[bot]
closed
2 months ago
3
Bump pyiron-base from 0.9.6 to 0.9.10
#120
dependabot[bot]
closed
2 months ago
1
Bump numpy from 1.26.4 to 2.0.1
#119
dependabot[bot]
closed
2 months ago
2
Bump pyiron-atomistics from 0.6.4 to 0.6.8
#118
dependabot[bot]
closed
2 months ago
2
Mtp
#117
pmrv
closed
2 months ago
2
Add simple run function and use in notebook
#116
pmrv
closed
2 months ago
2
Bump pyiron-snippets from 0.1.1 to 0.1.3
#115
dependabot[bot]
closed
2 months ago
3
Bump pyiron-atomistics from 0.6.3 to 0.6.4
#114
dependabot[bot]
closed
2 months ago
1
Fix some issues with potential plotting functions and add new ones
#113
pmrv
closed
2 months ago
1
fix get_table update bug
#112
pmrv
closed
2 months ago
1
Remove old executable overloads
#111
pmrv
opened
2 months ago
1
Write and return default mlip.ini in potential_files
#110
pmrv
closed
2 months ago
1
Bump pyiron-base from 0.9.5 to 0.9.6
#109
dependabot[bot]
closed
2 months ago
1
Bump matplotlib from 3.8.4 to 3.9.1
#108
dependabot[bot]
closed
1 month ago
3
ModuleNotFoundError: No module named 'pyiron_potentialfit.spgfit'
#107
lfzhu-phys
closed
3 months ago
7
Bump pyiron-base from 0.9.4 to 0.9.5
#106
dependabot[bot]
closed
3 months ago
1
Bump scipy from 1.13.1 to 1.14.0
#105
dependabot[bot]
closed
2 months ago
1
Bump pyiron-atomistics from 0.6.2 to 0.6.3
#104
dependabot[bot]
closed
3 months ago
1
Add PotentialMetrics
#103
pmrv
opened
3 months ago
1
Methods for train test splits and more
#102
pmrv
opened
3 months ago
1
Bump pyiron-base from 0.9.1 to 0.9.4
#101
dependabot[bot]
closed
3 months ago
1
Next