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code cleanup and documentation sweep
Test and Lint #90: Commit 91f8af5 pushed by wolearyc
August 22, 2024 20:02 2m 3s gnn
gnn
August 22, 2024 20:02 2m 3s
made architecture compatable with structural symmetries
Test and Lint #89: Commit b602bbf pushed by wolearyc
August 21, 2024 02:50 38s gnn
gnn
August 21, 2024 02:50 38s
implemented batching in gnn model
Test and Lint #88: Commit 6579683 pushed by wolearyc
August 19, 2024 23:22 34s gnn
gnn
August 19, 2024 23:22 34s
batch support for _radius_graph_pbc
Test and Lint #87: Commit 3e7cf05 pushed by wolearyc
August 19, 2024 20:57 35s gnn
gnn
August 19, 2024 20:57 35s
draft implementation
Test and Lint #86: Commit 7dda1d4 pushed by wolearyc
August 19, 2024 17:10 35s gnn
gnn
August 19, 2024 17:10 35s
small readme edit
Test and Lint #85: Commit 79d2b3e pushed by wolearyc
August 19, 2024 17:07 1m 19s gnn
gnn
August 19, 2024 17:07 1m 19s
small readme edit
Test and Lint #84: Commit 79d2b3e pushed by wolearyc
August 16, 2024 22:13 1m 21s gnn
gnn
August 16, 2024 22:13 1m 21s
small readme edit
Test and Lint #83: Commit 79d2b3e pushed by wolearyc
August 16, 2024 20:01 1m 18s 0.2.0
August 16, 2024 20:01 1m 18s
small readme edit
Test and Lint #82: Commit 79d2b3e pushed by wolearyc
August 16, 2024 19:59 1m 19s main
August 16, 2024 19:59 1m 19s
Merge pull request #6 from wolearyc/dev
Test and Lint #81: Commit 8553e86 pushed by wolearyc
August 16, 2024 19:51 1m 17s main
August 16, 2024 19:51 1m 17s
0.2.0 PR
Test and Lint #80: Pull request #6 opened by wolearyc
August 16, 2024 19:50 1m 18s dev
dev
August 16, 2024 19:50 1m 18s
clarified units
Test and Lint #79: Commit 598262a pushed by wolearyc
August 16, 2024 19:45 1m 15s dev
dev
August 16, 2024 19:45 1m 15s
updated guides
Test and Lint #78: Commit fe30aed pushed by wolearyc
August 16, 2024 17:58 1m 19s dev
dev
August 16, 2024 17:58 1m 19s
documentation sweep
Test and Lint #77: Commit 2794893 pushed by wolearyc
August 16, 2024 01:10 1m 15s dev
dev
August 16, 2024 01:10 1m 15s
modernized build system, version bump
Test and Lint #76: Commit d2cbf47 pushed by wolearyc
August 15, 2024 04:08 1m 19s dev
dev
August 15, 2024 04:08 1m 19s
added tests, minor bug fixes
Test and Lint #75: Commit 7c14537 pushed by wolearyc
August 15, 2024 03:16 1m 19s dev
dev
August 15, 2024 03:16 1m 19s
displaced structure writing
Test and Lint #74: Commit a66fb31 pushed by wolearyc
August 14, 2024 04:31 1m 8s dev
dev
August 14, 2024 04:31 1m 8s
clarified cartesian displacements/directions. cartesian_ -> cart_.
Test and Lint #73: Commit 54a0736 pushed by wolearyc
August 13, 2024 23:55 1m 14s dev
dev
August 13, 2024 23:55 1m 14s
implemented properties. fractional_positions -> positions
Test and Lint #72: Commit 9e89126 pushed by wolearyc
August 13, 2024 22:22 1m 15s dev
dev
August 13, 2024 22:22 1m 15s
added dummy models
Test and Lint #71: Commit b78da1b pushed by wolearyc
August 13, 2024 17:19 1m 15s dev
dev
August 13, 2024 17:19 1m 15s
added read_positions
Test and Lint #70: Commit 2ecd1ed pushed by wolearyc
August 13, 2024 16:46 1m 11s dev
dev
August 13, 2024 16:46 1m 11s
added UsageError
Test and Lint #69: Commit 20d1007 pushed by wolearyc
August 13, 2024 16:14 1m 8s dev
dev
August 13, 2024 16:14 1m 8s
documentation pass
Test and Lint #68: Commit f1c6a13 pushed by wolearyc
August 13, 2024 03:04 1m 10s dev
dev
August 13, 2024 03:04 1m 10s
refactored io to discourage use of generics
Test and Lint #67: Commit 1cbb968 pushed by wolearyc
August 13, 2024 00:42 1m 14s dev
dev
August 13, 2024 00:42 1m 14s
added POSCAR reading
Test and Lint #66: Commit 6a92d8b pushed by wolearyc
August 12, 2024 03:09 1m 26s dev
dev
August 12, 2024 03:09 1m 26s
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