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materials-modeling
icet
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Closed
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Created date
Fixed errors in testing when running on Debian
!263
· created
Feb 18, 2019
by
William Armando Munoz
0.3
Bug
Review
Tests
Merged
2
updated
Feb 19, 2019
Resolve 267-provide-data-analysis-helper-functions
!260
· created
Feb 15, 2019
by
Erik Fransson
0.3
Doing
Feature
Merged
74
1
updated
Feb 19, 2019
Resolve "Input atoms object is changed unexpectedly when running MC"
!258
· created
Feb 14, 2019
by
William Armando Munoz
0.3
Bug
Doing
Merged
3
1
updated
Mar 27, 2019
ENH: Added last_structure property to base_ensemble
!257
· created
Feb 14, 2019
by
William Armando Munoz
0.3
Code Structure
Doing
Feature
Closed
5
updated
Feb 14, 2019
Resolve "Improve handling of species argument in ClusterSpace"
!256
· created
Feb 14, 2019
by
Erik Fransson
0.3
Bug
Interface
To Do
icet
Merged
updated
Feb 14, 2019
Resolve "Fix handling of non-pbc systems"
!255
· created
Feb 14, 2019
by
Erik Fransson
0.3
Feature
Tests
To Do
Merged
24
updated
Feb 15, 2019
MAIN: Renamed the site occupancy factor observer and fixed the doc string.
!253
· created
Feb 06, 2019
by
Joakim Brorsson
0.3
Code Structure
Interface
Review
Merged
updated
Feb 06, 2019
Resolve "Failing tests in test_cluster_counts"
!252
· created
Jan 31, 2019
by
William Armando Munoz
0.3
Bug
CI
Doing
Tests
Merged
6
1
updated
Feb 11, 2019
Resolve "Let cluster_space.primitive_structure return structure with the actual elements"
!251
· created
Jan 29, 2019
by
Magnus Rahm
0.3
Bug
Doing
Interface
icet
Merged
5
updated
Feb 04, 2019
Saving runtime data as list of dicts in datacontainer
!250
· created
Jan 22, 2019
by
William Armando Munoz
0.3
Merged
10
updated
Jan 23, 2019
ENH: Added site occupancy factor observer together with a unittest.
!249
· created
Jan 21, 2019
by
Joakim Brorsson
0.3
Feature
Interface
Review
mchammer
Merged
52
updated
Feb 05, 2019
WIP: Resolve "Implement SiteOccupancyFactor observer"
!248
· created
Jan 21, 2019
by
Joakim Brorsson
0.3
Feature
Interface
Review
mchammer
Closed
1
updated
Jan 21, 2019
Extending JSONEncoder to avoid failures when saving np.int64 parameters to file
!247
· created
Jan 17, 2019
by
William Armando Munoz
0.3
Bug
Doing
mchammer
Merged
1
updated
Jan 17, 2019
DOC: added information on objective of basic tutorial
!246
· created
Jan 17, 2019
by
Paul Erhart
0.3
Documentation
Doing
Merged
updated
Jan 17, 2019
Resolve "Upgrade MC tutorial"
!244
· created
Jan 16, 2019
by
Magnus Rahm
0.3
Documentation
Review
Merged
1
updated
Jan 16, 2019
Fixed: empty structure container crashes when writing to file
!243
· created
Jan 15, 2019
by
William Armando Munoz
0.3
Bug
Merged
updated
Jan 16, 2019
Resolve "Save last state of MC run even if there is no data container filename specified"
!241
· created
Dec 10, 2018
by
William Armando Munoz
0.3
Code Structure
Doing
Feature
mchammer
Merged
15
1
updated
Dec 18, 2018
Clean up of C++ code mostly OrbitList related
!240
· created
Dec 10, 2018
by
Paul Erhart
0.3
Merged
44
updated
Dec 13, 2018
Resolve "Pruning functionality"
!239
· created
Dec 07, 2018
by
Mattias Ångqvist
0.3
Doing
Feature
Interface
Merged
5
3
updated
Dec 10, 2018
Resolve "Clean up warnings during compilation of icet_cpp via setup.py"
!238
· created
Dec 06, 2018
by
Paul Erhart
0.3
CI
Code Quality
Merged
6
updated
Dec 10, 2018
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