qpms/qpms
Marek Nečada 83b8b72578 Quaternions and Wigner matrix elements; untested.
Former-commit-id: 27dfd620a73f7ec246882863239e96a29c87a867
2019-02-22 05:35:38 +00:00
..
apps General 2D vector translation coefficient app. 2018-12-12 12:03:30 +02:00
data Precompiled tabulated version of gaunt coeffs + tests. 2018-02-12 23:39:51 +00:00
tests Lattice sum constants fators 2018-08-21 15:13:42 +00:00
BUGS.rst Wrong radial part of longitudinal waves -> BUGS file 2018-02-04 22:23:02 +00:00
__init__.py Irrep generating function to a module (end of ipynb copy-pasting) 2018-09-22 04:29:30 +03:00
assert_cython_workaround.h The calculator module now works in python 2017-04-26 14:12:29 +03:00
bessel.c indent 2018-05-06 19:13:10 +00:00
bessels.c A switch safety default statement. 2018-08-27 07:50:37 +03:00
bessels.h Fix comments and limits (at least I think it's a fix) 2018-05-14 15:58:32 +00:00
constants.py constants.py: unit conversions 2018-12-25 22:15:23 +02:00
ewald.c Rename ewald3_constants, move legacy code 2018-12-21 19:31:45 +00:00
ewald.h Rename ewald3_constants, move legacy code 2018-12-21 19:31:45 +00:00
ewald_legacy.c Rename ewald3_constants, move legacy code 2018-12-21 19:31:45 +00:00
ewaldsf.c ewald.c fix new init memory management. 2018-12-11 11:09:38 +00:00
gaunt.c The calculator module now works in python 2017-04-26 14:12:29 +03:00
gaunt.h Precompiled tabulated version of gaunt coeffs + tests. 2018-02-12 23:39:51 +00:00
gaunt_precompiled.c Precompiled tabulated version of gaunt coeffs + tests. 2018-02-12 23:39:51 +00:00
groups.h qpms_finite_group_t and hard-coded group code generator 2019-02-21 17:38:43 +02:00
hexpoints.py Fix memory corruption, python package installability 2018-05-15 14:37:05 +03:00
hexpoints_c.pyx Fix memory corruption, python package installability 2018-05-15 14:37:05 +03:00
indexing.h scatsystem: T-matrix manipulation. 2019-02-21 03:48:35 +00:00
kahansum.h Kahansum fix header 2018-05-14 18:35:28 +00:00
konvence Types for vswfs 2017-12-17 17:07:19 +00:00
latticegens.c Generic ("any coordinate system") union point type 2018-12-10 17:10:47 +02:00
lattices.h Update forgotten struct name 2018-12-25 23:50:39 +02:00
lattices2d.c Fix reciprocal basis in lattices2d.c. New ewaldshift test gives results consistent with the legacy code. 2018-12-11 22:22:25 +00:00
lattices2d.py nd generalisation of function for reciprocal basis 2017-08-03 08:11:28 +00:00
legacy.py Fix of the previous 2017-05-08 20:20:57 +03:00
legendre.c Xu's antinormalisation (broken, though) 2018-05-09 08:51:41 +00:00
lrhankel_recspace_dirty.c Fix comments and limits (at least I think it's a fix) 2018-05-14 15:58:32 +00:00
modules.rst Description of the modules, todos, remove unused imports. 2017-07-11 11:57:03 +03:00
proftest.c Axes bugfix 2017-05-03 08:08:58 +03:00
přehled.md Bessel transform mathematica results etc. 2018-01-15 15:14:15 +02:00
qpms_c.pyx cdef extern includes to a separate file 2019-02-18 14:42:44 +02:00
qpms_cdefs.pxd cdef extern includes to a separate file 2019-02-18 14:42:44 +02:00
qpms_p.py More variable choice of k in loaded W files 2019-02-07 00:36:59 +02:00
qpms_specfunc.h Various uncommitted mods and fixes 2018-03-28 18:28:33 +03:00
qpms_types.h Doxygen fixes. 2019-02-19 21:41:10 +00:00
scatsystem.c T-matrix interpolator. 2019-02-21 13:27:27 +02:00
scatsystem.h qpms_finite_group_t and hard-coded group code generator 2019-02-21 17:38:43 +02:00
scattering.py Fix memory corruption, python package installability 2018-05-15 14:37:05 +03:00
scripts_common.py Define particle / T-matrix specifications as namedtuples. 2017-07-18 16:07:31 +03:00
symmetries.c C implementation of the basic point group symmetries in uvswf basis. 2019-02-20 00:58:49 +00:00
symmetries.h C implementation of the basic point group symmetries in uvswf basis. 2019-02-20 00:58:49 +00:00
symmetries.py qpms_finite_group_t and hard-coded group code generator 2019-02-21 17:38:43 +02:00
test_gaunt.c Precompiled tabulated version of gaunt coeffs + tests. 2018-02-12 23:39:51 +00:00
test_translations.c generalise translations; does not give right values yety 2018-02-08 05:01:41 +02:00
test_translations2.c generalise translations; does not give right values yety 2018-02-08 05:01:41 +02:00
test_translations_xu_multipliers.c "fix" the q ranges for the B coefficients in translations.c 2018-03-07 21:32:05 +02:00
test_vswf_pitau.c Rozbil jsem to, jdu domů. 2018-01-30 01:09:48 +02:00
testcases_taylor.REMOVED.git-id generalise translations; does not give right values yety 2018-02-08 05:01:41 +02:00
timetrack.py Move time tracking functions to separate file. 2017-05-10 11:43:11 +03:00
tiny_inlines.h Implement LR part of 1D in 3D Ewald sum along z-axis; compiles, untested 2018-11-24 12:51:57 +00:00
tmatrices.h Some "declarations of intent" for new C code. 2018-12-25 22:34:37 +02:00
tmatrices.py TMatrices (M,N) order option 2019-02-14 00:07:53 +02:00
translations.c General 2D vector translation coefficient app. 2018-12-12 12:03:30 +02:00
translations.h General 2D vector translation coefficient app. 2018-12-12 12:03:30 +02:00
types.py separate C header file for types 2017-12-17 17:02:58 +02:00
vecprint.c indent 2018-05-06 19:13:10 +00:00
vectors.h qpms_finite_group_t and hard-coded group code generator 2019-02-21 17:38:43 +02:00
vswf.c T-matrix interpolator. 2019-02-21 13:27:27 +02:00
vswf.h T-matrix interpolator. 2019-02-21 13:27:27 +02:00
wigner.c Quaternions and Wigner matrix elements; untested. 2019-02-22 05:35:38 +00:00
wigner.h Quaternions and Wigner matrix elements; untested. 2019-02-22 05:35:38 +00:00