qpms/tests
Marek Nečada 85fb772c40 Testing shifted point ewald sums
Former-commit-id: 0951b2895e4b642aa9ae0365df0b1795fc7ed0b3
2018-09-13 06:07:26 +03:00
..
bessel_precision Various uncommitted mods and fixes 2018-03-28 18:28:33 +03:00
gsl-intgamma Hypergeometric 2F2 for calculating lattice sum errors 2018-09-11 10:07:37 +03:00
lattice Malá illustrace effektivity řazení r-ek 2018-08-26 20:28:46 +00:00
Amaxcumsum.c symbolic calculation of translation coefficients in SageMath 2018-02-26 05:21:46 +00:00
Bmaxcumsum.c symbolic calculation of translation coefficients in SageMath 2018-02-26 05:21:46 +00:00
cruzan_A.m Testing translation coefficients – found some irregularities. 2018-03-07 18:44:32 +02:00
cruzan_B.m Testing translation coefficients – found some irregularities. 2018-03-07 18:44:32 +02:00
ewalds.c Fix normalisation of test sigma0 factor. Ewald sum working now! 2018-09-13 05:32:57 +03:00
ewaldshift.c Testing shifted point ewald sums 2018-09-13 06:07:26 +03:00
gauntgen.m gaunt coeff generators mathematica 2018-02-13 01:45:26 +02:00
gauntgenbare.m gaunt coeff generators mathematica 2018-02-13 01:45:26 +02:00
gauntmaxcumsum.c Precompiled tabulated version of gaunt coeffs + tests. 2018-02-12 23:39:51 +00:00
test_qpms_p.py Correct flips for magnetic part. Some tests. 2016-08-09 14:39:45 +03:00
transcoeff_cruzan.py Some progress on the sage implementation/test of the translation coeffs 2018-03-28 18:23:49 +03:00