Marek Nečada
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08b8a1a315
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WIP generate 3D lattices
Former-commit-id: 16c6f7779db68a3169dbc77a6adb9ffdd6ad374a
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2019-09-07 12:39:17 +03:00 |
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Marek Nečada
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658c564a0c
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Some 3D lattice functionality, little refactoring.
Former-commit-id: 8e6572c7352e3b9a75bc13585d688f1c72d378e1
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2019-09-07 11:23:16 +03:00 |
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Marek Nečada
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c632ee36c5
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QPMS_UNLIKELY macros to qpms_error.h
Former-commit-id: d879a2105fd35a7d17f090842b03286fd310fbc1
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2019-09-02 12:03:27 +03:00 |
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Marek Nečada
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4d4ab9936b
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Variable Lovász condition parameter
Former-commit-id: 726d5c1b1dc03a5b11f8d7b32e6bf589efec369d
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2019-08-25 21:17:23 +03:00 |
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Marek Nečada
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953132e4c9
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Force doubles in the LLL-reduced array in numpy.
Former-commit-id: 70cffb53ff5b15515da8dd8ac18f74721f2c3b48
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2019-08-25 19:27:45 +03:00 |
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Marek Nečada
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0ea3510575
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Lenstra-Lenstra-Lovász lattice basis reduction.
Former-commit-id: 3ada9f1ebf783d07c31671fd81cb6f7d6fe6187b
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2019-08-25 18:58:05 +03:00 |
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Marek Nečada
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947f499bbf
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Print the argument return value in QPMS_ENSURE_SUCCESS.
Former-commit-id: 2aa9742b6bb1a10b963a197419af7ef57b7999c1
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2019-08-23 11:26:22 +03:00 |
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Marek Nečada
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32c9c2a434
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qpms_error.h remove implicit dependency on stdbool.h
Former-commit-id: 8d6d3f0cf0e33e8f9401559625f7b3261d140cd6
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2019-08-23 09:40:45 +03:00 |
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Marek Nečada
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cbbdec5963
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Fix test for k != 0
Former-commit-id: e7a3099c4a28631129c07f82a71abc3edacfb7e5
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2019-08-21 11:42:24 +03:00 |
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Marek Nečada
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d91fdc2e80
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More scalar Ewald tests (some pass!)
Former-commit-id: 85c3f542c317a7f7bb94bf8833a840d5cf82288d
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2019-08-21 11:26:28 +03:00 |
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Marek Nečada
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ad3d2d8071
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Fix incomplete gamma via continued fractions for complex z.
Former-commit-id: 13ae61b958919bfcca2d3828bc7d38b0b6cbf77b
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2019-08-20 17:31:43 +03:00 |
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Marek Nečada
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ce905eb0a4
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Expose my incomplete gamma function in Python.
More sophisticated GSL error handling
Former-commit-id: 4233d01d8aff64b00502c55cb50b54faa5c25ceb
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2019-08-20 12:46:28 +03:00 |
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Marek Nečada
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baad6b75aa
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Briefer test output
Former-commit-id: 31ebc020e2de9578cef908ff9d3b42cf7fcb6451
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2019-08-20 08:52:23 +03:00 |
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Marek Nečada
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a66f04a8c2
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Continuos fractions for incomplete gamma, extending the domain a bit.
Former-commit-id: 838b5bd6c34d37348253aa21f45bb7601c8a6abb
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2019-08-19 16:54:44 +03:00 |
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Marek Nečada
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20fac6036f
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Complex wave number for ewald sum (failing) + unit test.
Former-commit-id: a6c5e566028602ecd1047bc0b44677a4eeae3046
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2019-08-19 15:10:39 +03:00 |
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Marek Nečada
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02e4e9c308
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Some doxygen to ewald.h
Former-commit-id: aa68c91e6e6546b36a73c1c315e074f74905657e
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2019-08-19 12:02:22 +03:00 |
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Marek Nečada
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a20a5ac067
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ewald translations legacy code removal
Former-commit-id: da74041f5105d6b3a3f9fe3ddaa7306e973bd440
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2019-08-19 10:55:45 +03:00 |
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Marek Nečada
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a5604bf0bc
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Merge branch 'master' into translations_cleanup
Former-commit-id: 80437d49a0bea655e3560aabc5a7b6dc7061aedc
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2019-08-19 10:29:31 +03:00 |
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Marek Nečada
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e971aa0e79
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Fix single translation coefficients.
Former-commit-id: 1c045d994bb46ed16350d294bacc9203854cd2ea
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2019-08-19 10:29:02 +03:00 |
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Marek Nečada
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9ea487df84
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translations.c return accidentally deleted function,
remove more legacy stuff
Former-commit-id: 6bb2033234a893e85a0242c10156a700bd2d3ceb
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2019-08-19 09:29:14 +03:00 |
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Marek Nečada
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8b9c5a794c
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translations legacy code removal
Former-commit-id: 98e883f9c7586208623acca05585f747dc57f911
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2019-08-19 08:01:59 +03:00 |
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Marek Nečada
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0b0ebf2bce
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Start modifying the tests structure.
Former-commit-id: 2e95b72fb3258fddd75a3b9c2ab23aa53b0a9d9a
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2019-08-17 13:57:24 +03:00 |
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Marek Nečada
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5820de30ef
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Ewald.h doxygen
Former-commit-id: b89871b97680d5262637e7c1af2186c1d1307a84
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2019-08-17 13:31:38 +03:00 |
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Marek Nečada
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7b8e7d39e5
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Branch hints in frequently used inlines
Former-commit-id: aff247930de71d535e5cb455828f993b244053a2
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2019-08-17 12:02:08 +03:00 |
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Marek Nečada
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3e427f35ae
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Additional notes for axially symmetric particles
Former-commit-id: 989527ac17b0daea7abb3b15a71ae66d9ae224bf
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2019-08-16 12:57:40 +03:00 |
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Marek Nečada
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3e6f004605
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Compiler warnings, doxygen fixes
Former-commit-id: 2686ab2db0a61327db1ef5ce3799f3e88fea0f49
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2019-08-16 11:17:59 +03:00 |
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Marek Nečada
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03188d43f7
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Fix the integrand for axially symmetric T-matrices.
Forgotten jacobian, FFS.
Former-commit-id: f9a409bd1f5af78bb460d4bd3a9aadf78cebc2a7
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2019-08-16 10:05:23 +03:00 |
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Marek Nečada
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5e2dcf2100
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VSWFNorm IntFlag / IntEnum fallback
Former-commit-id: f1cc46f208bdceac972409836a238a56966277a4
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2019-08-15 15:19:54 +03:00 |
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Marek Nečada
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4bbdfbfbfc
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Convenience methods in cymaterials
Former-commit-id: dc27285f1d23c0cda3c9d80fe073aafc86f77277
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2019-08-15 14:27:36 +03:00 |
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Marek Nečada
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5a9219a4f6
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Expose single vswf functions to cython.
Former-commit-id: 7fd1183cdab2d6f60b446879a875dab4d673da73
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2019-08-14 11:04:42 +03:00 |
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Marek Nečada
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1bf9c0b44e
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Cython bindings for "pi, tau" functions
Former-commit-id: 74edc5a7a431a190150c4e1cbb3563809c6b9c01
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2019-08-13 17:18:39 +03:00 |
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Marek Nečada
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f62cfbe7a0
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Test whether single vswf and vswf array give the same result
Former-commit-id: ad74493b0f8854cfda302d8c98f2cdc216bc276c
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2019-08-13 14:38:02 +03:00 |
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Marek Nečada
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7a0386086a
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Functions to calculate the R,Q matrices for axially symmetric particles separately.
Former-commit-id: 0861a9014f293153b786b879bb3803d5ee002b56
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2019-08-13 13:30:48 +03:00 |
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Marek Nečada
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4ac2a7b72e
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Fix word in doxygen.
Former-commit-id: 89ec5ba36cfe23b33331984e06b4de386db93338
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2019-08-13 11:27:38 +03:00 |
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Marek Nečada
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2e037550b5
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Build libqpms as shared library.
Former-commit-id: 218d30a8502e5ea5814e4d8e119b750ca93d257f
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2019-08-12 16:33:54 +03:00 |
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Marek Nečada
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82337ca07f
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WIP T-matrix generators debugging
Former-commit-id: e3708a28b1fe62522fa45527452d2aa1c37bca49
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2019-08-12 11:18:25 +03:00 |
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Marek Nečada
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8ec697a1dc
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Constructors for (some) T-matrix generator types
Former-commit-id: d936f5c0b9ee3a3ed8c256b1064c245d04e54c75
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2019-08-12 05:41:36 +03:00 |
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Marek Nečada
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5094fc1bc4
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WIP cython wrappers for T-matrix generators
Former-commit-id: 8f3cabbc8039e8096d91bc4c21bcb3380638820d
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2019-08-11 23:37:25 +03:00 |
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Marek Nečada
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d00e46b908
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Custom python EpsMuGenerators seem to work
Former-commit-id: b3a38dde88b019182fcee4e62028b93fe0bf7aa5
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2019-08-11 19:11:43 +03:00 |
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Marek Nečada
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4572322553
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Experimental support for custom python-defined material functions.
Former-commit-id: acf19bb2537505922110d7de46cee52e76811637
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2019-08-11 19:06:50 +03:00 |
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Marek Nečada
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6c73a964d9
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Fix cymaterials (bad dereference)
Former-commit-id: 3480b7c8ed9d34370a092f700dd623676d70e64f
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2019-08-11 16:19:37 +03:00 |
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Marek Nečada
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38ecd6bce1
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Material generator cython wrappers (partly broken)
Former-commit-id: 881a182939bae3cccb545d51f1d138997bdf9c5c
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2019-08-11 09:43:45 +03:00 |
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Marek Nečada
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7e010fda1d
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More specific imports
Former-commit-id: 47a8ca8ef3375d0bffa1776b923cc06bf7496b94
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2019-08-10 10:54:34 +03:00 |
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Marek Nečada
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56147ef91d
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More specific imports
Former-commit-id: cb3923358702d42e2453bcbfd9712178731a082f
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2019-08-10 10:15:08 +03:00 |
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Marek Nečada
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1aa64248fc
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Split away CTMatrix, TMatrixInterpolator
Former-commit-id: ca92a0938f12fda858794b203e196366f2466a6f
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2019-08-10 09:55:50 +03:00 |
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Marek Nečada
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6ea386d759
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Split away MaterialInterpolator
Former-commit-id: a882ac5e1a6fa38137fa9059fda53c671534128b
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2019-08-10 09:40:59 +03:00 |
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Marek Nečada
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5d1f05984e
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Split trans_calculator to a separate extension
Former-commit-id: eb6a55246e0fab6078906e317e31611f385a677d
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2019-08-10 08:57:24 +03:00 |
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Marek Nečada
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0504f98bc0
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Make the splitted setup work
Former-commit-id: 9c8a7e4d1131c40ceb27a4b1a9c54d80c319394b
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2019-08-10 08:08:16 +03:00 |
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Marek Nečada
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371a8a5f7c
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Start splitting qpms_c.pyx
Former-commit-id: bb2e68dc4cb7f85769ddaf5533298ab1f0e84f5b
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2019-08-09 21:54:13 +03:00 |
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Marek Nečada
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1ef0c0ad4e
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Update qpms_cdefs.pxd
Former-commit-id: 77ffd62660d9cc0c109c6a49290ea2f3f6f2a54e
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2019-08-09 17:45:12 +03:00 |