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subroutine | eri_sph_coord_gbl::eri_sph_coord_final |
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subroutine | eri_sph_coord_gbl::olap_kei_sph (lena, xa, ya, za, acnorm, anorms, la, aexps, acoefs, ind_a, lenb, xb, yb, zb, bcnorm, bnorms, lb, bexps, bcoefs, ind_b, olap_column, kei_column, integrals, int_index) |
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subroutine | eri_sph_coord_gbl::allocate_cf_space (la, lb) |
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subroutine | eri_sph_coord_gbl::olap_kei_shell_sph (lena, xa, ya, za, acnorm, anorms, la, aexps, acoefs, lenb, xb, yb, zb, bcnorm, bnorms, lb, bexps, bcoefs, olap_column, kei_column, integrals) |
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subroutine | eri_sph_coord_gbl::eri_sph (lena, xa, ya, za, anorms, la, aexps, acoefs, ind_a, lenb, xb, yb, zb, bnorms, lb, bexps, bcoefs, ind_b, lenc, xc, yc, zc, cnorms, lc, cexps, ccoefs, ind_c, lend, xd, yd, zd, dnorms, ld, dexps, dcoefs, ind_d, two_el_column, int_index, keep_ab_cd_order, indexing_method, do_tails_for_this_quartet, ab_is_continuum, tgt_prop, tgt_pair, rmat_radius, sph_ints) |
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subroutine | eri_sph_coord_gbl::allocate_space (la, lb, lc, ld, lena, lenb, lenc, lend) |
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subroutine | eri_sph_coord_gbl::eri_shell_sph (lena, xa, ya, za, anorms, la, aexps, acoefs, lenb, xb, yb, zb, bnorms, lb, bexps, bcoefs, lenc, xc, yc, zc, cnorms, lc, cexps, ccoefs, lend, xd, yd, zd, dnorms, ld, dexps, dcoefs, two_el_column, eri_ints) |
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subroutine | eri_sph_coord_gbl::contract_AB_CD (la, lb, n_ij, sum_AB, lc, ld, n_kl, sum_CD, cpl_ABCD, eri_ints, two_el_column) |
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subroutine | eri_sph_coord_gbl::mat_T_mat_mul_special_blocking (A, B, C, m, n, k, stride_a, A_base, B_base, C_base) |
| Form C := A**T*B (+ C) More...
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subroutine | eri_sph_coord_gbl::mat_T_mat_mul_special (A, B, C, m, n, k, stride_a, A_base, B_base, C_base) |
| Form C := A**T*B (+ C) More...
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subroutine | eri_sph_coord_gbl::calculate_F_ij (la, lap, lb, lbp, n_ij, data_AB, solid_harmonics_ab, is_cd, rA_eq_rB, F_X) |
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subroutine | eri_sph_coord_gbl::sum_over_map_mbp_contract_i_j (la, lb, n_ij, solid_harmonics_ab, data_AB, sum_AB, is_cd, rA_eq_rB, lc_p_ld) |
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subroutine | eri_sph_coord_gbl::mat_mat_mul (A, B, C, m, n, k, add_to_C, C_base) |
| Form C := A*B (+ C) More...
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subroutine | eri_sph_coord_gbl::mat_T_mat_mul (A, B, C, m, n, k, add_to_C, C_base) |
| Form C := A**T*B (+ C) More...
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subroutine | eri_sph_coord_gbl::calculate_ABCD_coefficients (la_p_lb, lc_p_ld, n_ij, n_kl, l_ijkl_L_coefficients, solid_harmonics_abcd, cpl_ABCD) |
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subroutine | eri_sph_coord_gbl::cfp_solh_1d (SH, x, y, z, L) |
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real(kind=cfp) function | eri_sph_coord_gbl::cnla (n, l, alp) |
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real(kind=cfp) function | eri_sph_coord_gbl::Lag_n_hlf_k (n, l, arg) |
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real(kind=cfp) function | eri_sph_coord_gbl::gen_binom (x, m) |
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