SIRIUS 7.5.0
Electronic structure library and applications
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Files | |
file | generate_alm_block.hpp [code] |
file | generate_gvec_ylm.hpp [code] |
Generate complex spherical harmonics for the local set of G-vectors. | |
file | generate_sbessel_mt.hpp [code] |
Generate spherical Bessel functions at the muffin-tin boundary for the local set of G-vectors. | |
file | matching_coefficients.hpp [code] |
Contains definition and partial implementation of sirius::Matching_coefficients class. | |
file | step_function.hpp [code] |
Generate unit step function for LAPW method. | |
file | sum_fg_fl_yg.hpp [code] |
LAPW specific function to compute sum over plane-wave coefficients and spherical harmonics. | |