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39 Commits

Author SHA1 Message Date
Atsushi Togo 57e9eb63d7 Update to spglib 1.8 2015-06-17 15:06:47 +09:00
Atsushi Togo b8ddc5ce12 Update spglib 2015-04-06 16:00:09 +09:00
Atsushi Togo 5cedccecc4 Update spglib to 1.7.3-pre3 2015-04-05 23:23:50 +09:00
Atsushi Togo 736a17a4b4 Update spglib to 1.7.2 2015-03-11 13:50:57 +09:00
Atsushi Togo e966fefc66 Update spglib 2015-02-10 15:39:32 +09:00
Atsushi Togo 7a9a3d45ab Spglib update to v1.7 2014-11-21 14:24:03 +09:00
Atsushi Togo bb0fbc5e76 Update spglib to v1.6.4 2014-10-16 18:03:30 +09:00
Atsushi Togo b0488b2965 Update spglib 2014-08-11 14:37:28 +09:00
Atsushi Togo a40f5efaa4 Spglib update 2014-08-10 22:57:33 +09:00
Atsushi Togo 236cdbc052 Spglib update 2014-08-10 22:47:06 +09:00
Atsushi Togo e6dc864591 Code refactoring 2014-07-07 17:16:56 +09:00
Atsushi Togo 081c0f6314 Creating interface to translate grid address to grid point index and making difference between single and double meshes clearer 2014-07-07 01:11:08 +09:00
Atsushi Togo 5b5b3c0afc Finding equivalent atoms with broken symmetry due to unusual supercell shape 2014-07-06 02:00:21 +09:00
Atsushi Togo 69a886e9d8 Boundary collection of collision matrix 2014-05-15 22:24:58 +09:00
Atsushi Togo a6045d5f14 Considering BZ boundary for triplets 2014-05-10 14:04:24 +09:00
Atsushi Togo a13800afc2 Considering BZ boundary for triplets 2014-05-08 22:20:17 +09:00
Atsushi Togo 4b3eafe6af Considering BZ boundary for triplets 2014-05-08 18:06:16 +09:00
Atsushi Togo 0677e62113 Under the implementation of collision matrix and LBTE conductivity 2014-04-28 16:22:55 +09:00
Atsushi Togo 4a183db2a2 Change output format of ir-triplets 2014-04-09 17:23:52 +09:00
Atsushi Togo 9045b0d200 Making interface for choosing the way to divide microzone by tetrahedra with 4 diagonals 2014-03-14 22:31:34 +01:00
Atsushi Togo d4aa573dad Spglib update 2014-02-14 11:08:10 +09:00
Atsushi Togo e9ed3fea65 Update for tetrahedron method implementing in C 2014-01-21 18:20:40 +09:00
Atsushi Togo b3be2f54d9 Update tetrahedron method implementing in C 2014-01-21 00:54:07 +09:00
Atsushi Togo 06e45f82fb Update for tetrahedron method implementing in C 2014-01-20 18:12:28 +09:00
Atsushi Togo e7fa7a313c spglib update for tetrahedron method 2014-01-20 01:00:04 +09:00
Atsushi Togo 65e9d31c97 Tetrahedron method update 2014-01-15 18:33:28 +09:00
Atsushi Togo 8a92314fdd Tetrahedron method in C is imported from spglib. 2014-01-07 18:34:03 +09:00
Atsushi Togo 0ab0fcd77c Minor fix 2013-12-21 16:36:37 +09:00
Atsushi Togo b260d0e6b8 BZ grid address order is modified. grid_address is not overwritten. 2013-10-09 13:15:45 +09:00
Atsushi Togo 1b7e3aa0e8 A boundary treatment for no-kappa-stars option in thermal conductivity 2013-09-27 16:15:33 +09:00
Atsushi Togo bbded2e982 Mesh sampling in reciprocal primitive lattice is transformed to that in BZ 2013-09-26 18:57:35 +09:00
Atsushi Togo 18074bdefa Implementation of relocate_BZ_grid_address 2013-09-22 23:03:35 +09:00
Atsushi Togo 79586369b6 Update spglib to v1.5.1 2013-09-10 14:01:49 +09:00
Atsushi Togo deebc21507 Boundary treatment of triplets when mesh number is even 2013-09-06 14:08:52 +09:00
Atsushi Togo 0ebe23a1ec Boundary treatment of triplets when mesh number is even 2013-09-05 18:30:32 +09:00
Atsushi Togo eedc4c2646 Update spglib 2013-04-15 16:58:00 +09:00
Atsushi Togo 3c3051fa29 Triplet search update 2013-03-03 17:43:40 +09:00
Atsushi Togo 51de88929e Update spglib to version 1.4 2012-12-14 17:58:10 +09:00
Atsushi Togo 7f5a732efb Commit version 1.6.3 2012-12-11 17:15:20 +09:00