Commit Graph

840 Commits

Author SHA1 Message Date
Marek Nečada 22d9f05ef8 This might somehow more stable
Former-commit-id: bc836c111d6a0bd14aa539c7d35e8987ff96d3da
2019-07-25 07:59:43 +03:00
Marek Nečada b939b1c177 I realised this approach is wrong.
I must do the quaternion sorting in otherway, probably using a separate
tree for each component (then what?).


Former-commit-id: 6de715751ddd41f6ffc72b274cadf58a765b3edd
2019-07-24 19:06:29 +03:00
Marek Nečada 1b63d75153 PointGroup cython class, fix many bugs (quaternion ambiguity).
Former-commit-id: 16835b9f03c4fbb28c414ce9844cabb30aabfb00
2019-07-24 18:26:12 +03:00
Marek Nečada 6a34c71017 Point group element generator and subgroup testing
Former-commit-id: 8d3e89facdac8e0744ada736d5b7453f23dc9ddc
2019-07-24 14:20:50 +03:00
Marek Nečada 36ea30952c Move stuff from pointgroup.h to pointgroups.c
Former-commit-id: 70431c71975fdbe21be76cf4d28f1f59614bd577
2019-07-24 11:28:44 +03:00
Marek Nečada 46e82e55e2 Untested generation of finite point groups
Former-commit-id: d61677f79685f69ba59f2f81ec7737b70b42d218
2019-07-24 11:13:13 +03:00
Marek Nečada d97945a43e Make quaternions.h compile at work (+ ATOL constant macro).
Why the hell did it compile at home, but fails at work?


Former-commit-id: 5237d9ffda0a2ad3defd22f74dd4ccc3005d7952
2019-07-24 11:00:11 +03:00
Marek Nečada e048a78055 rename wigner.h to quaternions.h
Former-commit-id: 190a4795704233f6743e3cf1b873e4cd8dae3936
2019-07-23 23:06:44 +03:00
Marek Nečada 0530895f84 Draft generators for finite axial qpms_pointgroup_t.
Former-commit-id: 0a9eba27d584038be532bb1590b7d5b6b98fba1b
2019-07-23 22:57:36 +03:00
Marek Nečada 1f8d146b13 Quaternion fix constants, approximate equality tests etc.
Former-commit-id: 91528cd0141572528a149bbbed074e17a1c19f58
2019-07-23 20:55:33 +03:00
Marek Nečada 859a3a11a8 Draft abstract t-matrix type
Former-commit-id: dd4e9f9ed7f50b5f6db3416d478c8b37a9d4e5b4
2019-07-23 17:21:56 +03:00
Marek Nečada 0ffee1a073 Solve scattering problem using LU decomposition.
Former-commit-id: 32388ecc2da5d60a3b3616a765c0ecaed87fb4fd
2019-07-23 15:50:31 +03:00
Marek Nečada 5758c5d587 Reverse modeproblem matrix sign so it applies directly to scattering
Former-commit-id: d05f8207bd86263ecdc93d3838e948c4fe90359a
2019-07-23 08:43:25 +03:00
Marek Nečada e05a79483d Apply T-matrices on incident fields vector.
Former-commit-id: c1cfd5a2c24651f55325d73430387a4e87276d48
2019-07-22 16:56:03 +03:00
Marek Nečada ef118d2d88 Access BaseSpec normalisation convention; minor tweaks
Former-commit-id: 3000084f187ac4d3f5e74c1ad27dd70097b9edd1
2019-07-22 12:25:57 +03:00
Marek Nečada c6e666f4e6 Error on (temporarily) unsupported normalisations.
Former-commit-id: b7ed7054cd4f717a430f9ef546f1d9967748edd7
2019-07-22 11:22:21 +03:00
Marek Nečada d01ab445fe Cython-wrap additional translations.h functions.
Former-commit-id: 4b1ad54f40167f66b6788cb2976ca854b7971a5e
2019-07-22 10:08:09 +03:00
Marek Nečada c87fc66b3c Test saving in newer LyX format
Former-commit-id: 68375ee370a993015157de1d58b149c9b925b360
2019-07-22 07:52:33 +03:00
Marek Nečada 29a521db81 ss irrep acked translation matrix attempt
Former-commit-id: 2d90bc2a40a7714eb3fa795b9fa9770387373513
2019-07-22 01:08:41 +03:00
Marek Nečada 9c7d69dc5c Get rid of dependency on Moble's quaternions.
Former-commit-id: 182aeda66992aa43c2c172c28a199feba0d6878f
2019-07-21 23:37:25 +03:00
Marek Nečada 52039f5cbb ss build translation matrix: enable other Bessel funcs.
Former-commit-id: 66d4993430322b7de00a408406b89972b7dd7c48
2019-07-21 21:14:11 +03:00
Marek Nečada 082cea31b2 Merge branch 'article_forgotten' into article
Former-commit-id: 70808d5661d0ddc2fb04a09e158d527a0d5d2700
2019-07-20 14:37:01 +03:00
Marek Nečada e26ca79a53 WSWF translations (TODO explicit form of the ops)
Former-commit-id: 44f286281af3f44208c2b1e2aabbe7234b0cd675
2019-07-20 13:54:17 +03:00
Marek Nečada b259bd46b4 WIP finite lattice
Former-commit-id: 0a8c5e45ffb0ee03b0867ba483c3a9960405f0af
2019-07-20 07:09:31 +03:00
Marek Nečada 53404689b9 WIP paper
Former-commit-id: 201398567e90c9dd9ad1dfeeb75c874c30316250
2019-07-20 07:03:50 +03:00
Marek Nečada ecda105d49 Data rescue
Former-commit-id: 98dfe7b8694d7c2556876da33d6700ed98b39a38
2019-07-19 11:20:13 +03:00
Marek Nečada 74655c0210 WIP finite systems + copypasta from hexlaser SM
Former-commit-id: 7fa2ae8308b4aa62fdb0986ac0ed669fad29d2a1
2019-07-18 22:50:01 +03:00
Marek Nečada e30eb45a36 Paper intro
Former-commit-id: ccbb88524c7561b087d89267c6cd09bc0daa3f08
2019-07-17 23:06:56 +03:00
Marek Nečada 5aa855af19 Definition of a structure specifying any 3D point groups.
Former-commit-id: b329c8136605e0b8c20bd1c2e562a52829e4c4c8
2019-07-16 16:05:17 +03:00
Marek Nečada 3a1adeaa25 Use errno
Former-commit-id: b1a8d1a27501cbd6fe57f42c5efa630862b60748
2019-07-16 14:25:30 +03:00
Marek Nečada a63348d414 Avoid silent crashing of TMatrixInterpolator.__cinit__()
Former-commit-id: fb6bfc9f52b8d0dadf89c93835360bca54cb66c9
2019-07-16 14:06:55 +03:00
Marek Nečada a315923750 Fix doxygen from previous commit
Former-commit-id: 4a4f9ba3b931d996bd0b7b4bae7b685b83b92a37
2019-07-16 08:23:39 +03:00
Marek Nečada 261ff9456f 3D point group classification enum type.
Former-commit-id: 70d88ebed3826a674780be401ee012d3701e960e
2019-07-16 08:14:59 +03:00
Marek Nečada 110723d4b1 Fix some weird newly appearing errors.
module_devel/scatsystem.ipynb however still crashes


Former-commit-id: b5385a90a9a94d21e07a46eed4f5386cb5fef12f
2019-07-15 18:11:50 +03:00
Marek Nečada ee86a20fd2 Cython nested union declaration workaround.
Former-commit-id: 283cd4a381b95928321a1b8b38ec5692cf657aba
2019-07-15 17:26:32 +03:00
Marek Nečada 911f6b758c WIP cython wrappers for plane waves in scatsys
Former-commit-id: 42cf85afc93e9cc63291b7030a7129a21e098826
2019-07-15 16:36:37 +03:00
Marek Nečada ebefc07e9d Implement plane wave expansion on scatsys; untested.
Former-commit-id: d54d13d1e1994a0b9cba0860e7095063b23ff276
2019-07-15 14:39:08 +03:00
Marek Nečada 9c15b8e4f2 linewrap long macros
Former-commit-id: 5d1e1d2b626f553b63e62b34345f43984dac9196
2019-07-15 13:58:55 +03:00
Marek Nečada 1b7ede5e1d Implement uvswf plane wave.
Former-commit-id: 591a742362fd311d8d7fbf12b147c8324e077f3c
2019-07-15 13:00:47 +03:00
Marek Nečada bc3780c1d1 New QPMS_INCOMPLETE_IMPLEMENTATION macro
Former-commit-id: 0b8596d8d7f4b307d2d24b612db5212d3ffe0c04
2019-07-15 09:16:51 +03:00
Marek Nečada 02a8161d3e Vector.h more convenience inlines
Former-commit-id: 4e0b0331fdb50192e9518d017f6bbc46fdf1fe1b
2019-07-14 23:55:45 +03:00
Marek Nečada 8eb0f9f2ea Convertors between csph_t and ccart3_t
Former-commit-id: 0d081dc430d23d8431c8b22d2d9a22de5ba86695
2019-07-14 23:26:03 +03:00
Marek Nečada 7d3c3769ee Prototypes of incident fields to scatsys
Former-commit-id: 067b40fcba12340580acf52c0af7845c462b5a58
2019-07-14 23:00:43 +03:00
Marek Nečada 52a76f557b Merge branch 'newnorm'
Former-commit-id: 7c1941cb4436ab1d7920c85df4a82ccba24cccb2
2019-07-14 21:01:31 +03:00
Marek Nečada 1ec776c8a8 New qpms_normalisation_t also in scatsystem.c; python module now
compiles.


Former-commit-id: ac877f894c124660f399bb3e70ed05ca42f565cb
2019-07-14 20:56:23 +03:00
Marek Nečada 5720e9998d Merge branch 'newnorm' of necada:~/repo/qpms into newnorm
Former-commit-id: 19b6714173e1e205b0d9c5fb6b853b09f892bae0
2019-07-14 20:24:36 +03:00
Marek Nečada 4eb4cdfcbe Some updates in cython related to new qpms_normalisation_t
Former-commit-id: 23ef001623ff6d6ffd847dfd72214aa8231ebda9
2019-07-14 20:19:13 +03:00
Marek Nečada 005bdaa2be Use the new qpms_normalisation_t also in cython parts
Former-commit-id: 58eb1c22724d3a94abb88d4c7b9af668a2faf116
2019-07-14 10:02:37 +03:00
Marek Nečada 0610f98854 Move some legacy code from qpms_types.h to normalisation.h; to be pruned later.
Former-commit-id: 0078e465757bc40f574837f196a7ab0c08529db8
2019-07-14 09:48:29 +03:00
Marek Nečada 45b8233862 Tag symmetries.c with non-implemented macros etc.
Former-commit-id: 0cf1dc127b43bdded6471501a666ce325e5528f5
2019-07-14 09:33:30 +03:00