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materials-modeling
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Created date
Fixed backward compatibility of cluster space (and expansion) files
!409
· created
Jan 14, 2020
by
Paul Erhart
1.2
Bug
Merged
5
updated
Jan 16, 2020
Corrected README.md
!408
· created
Jan 14, 2020
by
Paul Erhart
1.2
Bug
Documentation
Merged
updated
Jan 15, 2020
Resolve "Supercell enumeration yields equivalent supercells for 2D systems"
!399
· created
Jan 10, 2020
by
Magnus Rahm
1.2
Bug
Merged
7
updated
Jan 17, 2020
Resolve "data_container should be data_container_filename"
!388
· created
Dec 18, 2019
by
Erik Fransson
1.2
Interface
Suggestion
User
Merged
8
1
updated
Jan 14, 2020
Resolve "Ground state finder using Mixed Integer Programming"
!365
· created
Nov 19, 2019
by
Joakim Brorsson
1.2
Feature
Merged
65
2
updated
Dec 05, 2019
Function for obtaining Wyckoff sites of a structure
!359
· created
Oct 12, 2019
by
Paul Erhart
1.2
Documentation
Feature
Tests
Merged
27
updated
Oct 24, 2019
355-rename-the-cluster_space-property-in-cluster-expansion
!353
· created
Sep 26, 2019
by
Erik Fransson
1.2
Interface
To Do
Merged
1
updated
Sep 26, 2019
409-cleaning-up-things-in-mchammer
!352
· created
Sep 26, 2019
by
Erik Fransson
1.2
Code Quality
Merged
1
updated
Sep 26, 2019
Resolve "Add short tutorial on non-pbc systems"
!351
· created
Sep 26, 2019
by
Erik Fransson
1.2
Documentation
To Do
Merged
4
1
updated
Oct 07, 2019
Update doc/userguide/source/index.rst
!349
· created
Sep 25, 2019
by
Mattias Ångqvist
1.2
Bug
Merged
3
updated
Sep 25, 2019
Resolve "Improved structure mapping"
!344
· created
Aug 28, 2019
by
Magnus Rahm
1.2
Feature
Merged
65
updated
Sep 25, 2019