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mirror of https://github.com/TREX-CoE/trexio.git synced 2024-12-23 04:43:57 +01:00
Commit Graph

770 Commits

Author SHA1 Message Date
27f9724772 correct (non)local_n_max naming 2021-03-02 16:52:05 +01:00
b798205974 add num_ prefix to (non)local_n_max 2021-03-02 16:46:20 +01:00
0f79754e9f typos and commas 2021-03-02 16:43:02 +01:00
cd7f5f53ed
Update README.md 2021-03-02 14:30:46 +01:00
49a73b6d75 Renamed trio in trexio 2021-03-02 13:57:01 +01:00
c58231e135 Added trex.config in JSON format.
Closes #1
2021-03-02 13:04:13 +01:00
Evgeny Posenitskiy
c3fd60fd6d
Merge pull request #11 from TREX-CoE/consecutive-test
consecutive testing for hdf5; fixes #10
2021-03-02 11:45:22 +01:00
a0172e26c1 consecutive testing for hdf5 2021-03-02 11:41:25 +01:00
cbb936564e added write_h5 test 2021-03-02 11:27:09 +01:00
Evgeny Posenitskiy
ff28a435d9
Merge pull request #2 from TREX-CoE/hdf5-backend
HDF5 backend
2021-03-02 11:04:01 +01:00
Evgeny Posenitskiy
2b228915ac
Merge branch 'master' into hdf5-backend 2021-03-02 11:03:15 +01:00
9cf8d26110 hdf5 backend working 2021-03-02 10:55:13 +01:00
472dd5fd91 add test to read nucleus_coord from hdf5 2021-02-23 18:20:14 +01:00
92f6a8fa81 replaced some ints with unsigned ints 2021-02-23 18:18:20 +01:00
29b4e4d313 WIP: hdf5: read_nucleus_coord works 2021-02-23 18:17:14 +01:00
ac9e1aa410 change int64 to uint64 2021-02-22 11:40:13 +01:00
258266004b TODO in org file 2021-02-22 10:56:16 +01:00
0c60cf78d9 Example works with no memory leaks 2021-02-20 18:16:10 +01:00
43bbcfcdbf Library compiles 2021-02-20 17:12:38 +01:00
Evgeny P
d56de54275
Initial commit 2021-01-18 15:48:36 +01:00