1 #include "simint/boys/boys.h"
2 #include "simint/ostei/gen/ostei_generated.h"
3 #include "simint/vectorization/vectorization.h"
4 #include <math.h>
5 #include <string.h>
6
7
ostei_i_h_k_f(struct simint_multi_shellpair const P,struct simint_multi_shellpair const Q,double screen_tol,double * const restrict work,double * const restrict INT__i_h_k_f)8 int ostei_i_h_k_f(struct simint_multi_shellpair const P,
9 struct simint_multi_shellpair const Q,
10 double screen_tol,
11 double * const restrict work,
12 double * const restrict INT__i_h_k_f)
13 {
14
15 SIMINT_ASSUME_ALIGN_DBL(work);
16 SIMINT_ASSUME_ALIGN_DBL(INT__i_h_k_f);
17 int ab, cd, abcd;
18 int istart, jstart;
19 int iprimcd, nprim_icd, icd;
20 const int check_screen = (screen_tol > 0.0);
21 int i, j;
22 int n;
23 int not_screened;
24 int real_abcd;
25 int iket;
26 int ibra;
27
28 // partition workspace
29 double * const INT__i_s_k_s = work + (SIMINT_NSHELL_SIMD * 0);
30 double * const INT__i_s_l_s = work + (SIMINT_NSHELL_SIMD * 1008);
31 double * const INT__i_s_m_s = work + (SIMINT_NSHELL_SIMD * 2268);
32 double * const INT__i_s_n_s = work + (SIMINT_NSHELL_SIMD * 3808);
33 double * const INT__k_s_k_s = work + (SIMINT_NSHELL_SIMD * 5656);
34 double * const INT__k_s_l_s = work + (SIMINT_NSHELL_SIMD * 6952);
35 double * const INT__k_s_m_s = work + (SIMINT_NSHELL_SIMD * 8572);
36 double * const INT__k_s_n_s = work + (SIMINT_NSHELL_SIMD * 10552);
37 double * const INT__l_s_k_s = work + (SIMINT_NSHELL_SIMD * 12928);
38 double * const INT__l_s_l_s = work + (SIMINT_NSHELL_SIMD * 14548);
39 double * const INT__l_s_m_s = work + (SIMINT_NSHELL_SIMD * 16573);
40 double * const INT__l_s_n_s = work + (SIMINT_NSHELL_SIMD * 19048);
41 double * const INT__m_s_k_s = work + (SIMINT_NSHELL_SIMD * 22018);
42 double * const INT__m_s_l_s = work + (SIMINT_NSHELL_SIMD * 23998);
43 double * const INT__m_s_m_s = work + (SIMINT_NSHELL_SIMD * 26473);
44 double * const INT__m_s_n_s = work + (SIMINT_NSHELL_SIMD * 29498);
45 double * const INT__n_s_k_s = work + (SIMINT_NSHELL_SIMD * 33128);
46 double * const INT__n_s_l_s = work + (SIMINT_NSHELL_SIMD * 35504);
47 double * const INT__n_s_m_s = work + (SIMINT_NSHELL_SIMD * 38474);
48 double * const INT__n_s_n_s = work + (SIMINT_NSHELL_SIMD * 42104);
49 double * const INT__o_s_k_s = work + (SIMINT_NSHELL_SIMD * 46460);
50 double * const INT__o_s_l_s = work + (SIMINT_NSHELL_SIMD * 49268);
51 double * const INT__o_s_m_s = work + (SIMINT_NSHELL_SIMD * 52778);
52 double * const INT__o_s_n_s = work + (SIMINT_NSHELL_SIMD * 57068);
53 SIMINT_DBLTYPE * const primwork = (SIMINT_DBLTYPE *)(work + SIMINT_NSHELL_SIMD*62216);
54 SIMINT_DBLTYPE * const restrict PRIM_INT__s_s_s_s = primwork + 0;
55 SIMINT_DBLTYPE * const restrict PRIM_INT__s_s_p_s = primwork + 22;
56 SIMINT_DBLTYPE * const restrict PRIM_INT__s_s_d_s = primwork + 52;
57 SIMINT_DBLTYPE * const restrict PRIM_INT__s_s_f_s = primwork + 106;
58 SIMINT_DBLTYPE * const restrict PRIM_INT__s_s_g_s = primwork + 186;
59 SIMINT_DBLTYPE * const restrict PRIM_INT__p_s_s_s = primwork + 291;
60 SIMINT_DBLTYPE * const restrict PRIM_INT__p_s_p_s = primwork + 354;
61 SIMINT_DBLTYPE * const restrict PRIM_INT__p_s_d_s = primwork + 444;
62 SIMINT_DBLTYPE * const restrict PRIM_INT__p_s_f_s = primwork + 606;
63 SIMINT_DBLTYPE * const restrict PRIM_INT__p_s_g_s = primwork + 846;
64 SIMINT_DBLTYPE * const restrict PRIM_INT__p_s_h_s = primwork + 1161;
65 SIMINT_DBLTYPE * const restrict PRIM_INT__d_s_s_s = primwork + 1539;
66 SIMINT_DBLTYPE * const restrict PRIM_INT__d_s_p_s = primwork + 1659;
67 SIMINT_DBLTYPE * const restrict PRIM_INT__d_s_d_s = primwork + 1839;
68 SIMINT_DBLTYPE * const restrict PRIM_INT__d_s_f_s = primwork + 2163;
69 SIMINT_DBLTYPE * const restrict PRIM_INT__d_s_g_s = primwork + 2643;
70 SIMINT_DBLTYPE * const restrict PRIM_INT__d_s_h_s = primwork + 3273;
71 SIMINT_DBLTYPE * const restrict PRIM_INT__d_s_i_s = primwork + 4029;
72 SIMINT_DBLTYPE * const restrict PRIM_INT__f_s_s_s = primwork + 4869;
73 SIMINT_DBLTYPE * const restrict PRIM_INT__f_s_p_s = primwork + 5059;
74 SIMINT_DBLTYPE * const restrict PRIM_INT__f_s_d_s = primwork + 5359;
75 SIMINT_DBLTYPE * const restrict PRIM_INT__f_s_f_s = primwork + 5899;
76 SIMINT_DBLTYPE * const restrict PRIM_INT__f_s_g_s = primwork + 6699;
77 SIMINT_DBLTYPE * const restrict PRIM_INT__f_s_h_s = primwork + 7749;
78 SIMINT_DBLTYPE * const restrict PRIM_INT__f_s_i_s = primwork + 9009;
79 SIMINT_DBLTYPE * const restrict PRIM_INT__f_s_k_s = primwork + 10409;
80 SIMINT_DBLTYPE * const restrict PRIM_INT__g_s_s_s = primwork + 11849;
81 SIMINT_DBLTYPE * const restrict PRIM_INT__g_s_p_s = primwork + 12119;
82 SIMINT_DBLTYPE * const restrict PRIM_INT__g_s_d_s = primwork + 12569;
83 SIMINT_DBLTYPE * const restrict PRIM_INT__g_s_f_s = primwork + 13379;
84 SIMINT_DBLTYPE * const restrict PRIM_INT__g_s_g_s = primwork + 14579;
85 SIMINT_DBLTYPE * const restrict PRIM_INT__g_s_h_s = primwork + 16154;
86 SIMINT_DBLTYPE * const restrict PRIM_INT__g_s_i_s = primwork + 18044;
87 SIMINT_DBLTYPE * const restrict PRIM_INT__g_s_k_s = primwork + 20144;
88 SIMINT_DBLTYPE * const restrict PRIM_INT__g_s_l_s = primwork + 22304;
89 SIMINT_DBLTYPE * const restrict PRIM_INT__h_s_s_s = primwork + 24329;
90 SIMINT_DBLTYPE * const restrict PRIM_INT__h_s_p_s = primwork + 24686;
91 SIMINT_DBLTYPE * const restrict PRIM_INT__h_s_d_s = primwork + 25316;
92 SIMINT_DBLTYPE * const restrict PRIM_INT__h_s_f_s = primwork + 26450;
93 SIMINT_DBLTYPE * const restrict PRIM_INT__h_s_g_s = primwork + 28130;
94 SIMINT_DBLTYPE * const restrict PRIM_INT__h_s_h_s = primwork + 30335;
95 SIMINT_DBLTYPE * const restrict PRIM_INT__h_s_i_s = primwork + 32981;
96 SIMINT_DBLTYPE * const restrict PRIM_INT__h_s_k_s = primwork + 35921;
97 SIMINT_DBLTYPE * const restrict PRIM_INT__h_s_l_s = primwork + 38945;
98 SIMINT_DBLTYPE * const restrict PRIM_INT__h_s_m_s = primwork + 41780;
99 SIMINT_DBLTYPE * const restrict PRIM_INT__i_s_s_s = primwork + 44090;
100 SIMINT_DBLTYPE * const restrict PRIM_INT__i_s_p_s = primwork + 44538;
101 SIMINT_DBLTYPE * const restrict PRIM_INT__i_s_d_s = primwork + 45378;
102 SIMINT_DBLTYPE * const restrict PRIM_INT__i_s_f_s = primwork + 46890;
103 SIMINT_DBLTYPE * const restrict PRIM_INT__i_s_g_s = primwork + 49130;
104 SIMINT_DBLTYPE * const restrict PRIM_INT__i_s_h_s = primwork + 52070;
105 SIMINT_DBLTYPE * const restrict PRIM_INT__i_s_i_s = primwork + 55598;
106 SIMINT_DBLTYPE * const restrict PRIM_INT__i_s_k_s = primwork + 59518;
107 SIMINT_DBLTYPE * const restrict PRIM_INT__i_s_l_s = primwork + 63550;
108 SIMINT_DBLTYPE * const restrict PRIM_INT__i_s_m_s = primwork + 67330;
109 SIMINT_DBLTYPE * const restrict PRIM_INT__i_s_n_s = primwork + 70410;
110 SIMINT_DBLTYPE * const restrict PRIM_INT__k_s_s_s = primwork + 72258;
111 SIMINT_DBLTYPE * const restrict PRIM_INT__k_s_p_s = primwork + 72798;
112 SIMINT_DBLTYPE * const restrict PRIM_INT__k_s_d_s = primwork + 73878;
113 SIMINT_DBLTYPE * const restrict PRIM_INT__k_s_f_s = primwork + 75822;
114 SIMINT_DBLTYPE * const restrict PRIM_INT__k_s_g_s = primwork + 78702;
115 SIMINT_DBLTYPE * const restrict PRIM_INT__k_s_h_s = primwork + 82482;
116 SIMINT_DBLTYPE * const restrict PRIM_INT__k_s_i_s = primwork + 87018;
117 SIMINT_DBLTYPE * const restrict PRIM_INT__k_s_k_s = primwork + 92058;
118 SIMINT_DBLTYPE * const restrict PRIM_INT__k_s_l_s = primwork + 97242;
119 SIMINT_DBLTYPE * const restrict PRIM_INT__k_s_m_s = primwork + 102102;
120 SIMINT_DBLTYPE * const restrict PRIM_INT__k_s_n_s = primwork + 106062;
121 SIMINT_DBLTYPE * const restrict PRIM_INT__l_s_s_s = primwork + 108438;
122 SIMINT_DBLTYPE * const restrict PRIM_INT__l_s_p_s = primwork + 109068;
123 SIMINT_DBLTYPE * const restrict PRIM_INT__l_s_d_s = primwork + 110418;
124 SIMINT_DBLTYPE * const restrict PRIM_INT__l_s_f_s = primwork + 112848;
125 SIMINT_DBLTYPE * const restrict PRIM_INT__l_s_g_s = primwork + 116448;
126 SIMINT_DBLTYPE * const restrict PRIM_INT__l_s_h_s = primwork + 121173;
127 SIMINT_DBLTYPE * const restrict PRIM_INT__l_s_i_s = primwork + 126843;
128 SIMINT_DBLTYPE * const restrict PRIM_INT__l_s_k_s = primwork + 133143;
129 SIMINT_DBLTYPE * const restrict PRIM_INT__l_s_l_s = primwork + 139623;
130 SIMINT_DBLTYPE * const restrict PRIM_INT__l_s_m_s = primwork + 145698;
131 SIMINT_DBLTYPE * const restrict PRIM_INT__l_s_n_s = primwork + 150648;
132 SIMINT_DBLTYPE * const restrict PRIM_INT__m_s_s_s = primwork + 153618;
133 SIMINT_DBLTYPE * const restrict PRIM_INT__m_s_p_s = primwork + 154333;
134 SIMINT_DBLTYPE * const restrict PRIM_INT__m_s_d_s = primwork + 155983;
135 SIMINT_DBLTYPE * const restrict PRIM_INT__m_s_f_s = primwork + 158953;
136 SIMINT_DBLTYPE * const restrict PRIM_INT__m_s_g_s = primwork + 163353;
137 SIMINT_DBLTYPE * const restrict PRIM_INT__m_s_h_s = primwork + 169128;
138 SIMINT_DBLTYPE * const restrict PRIM_INT__m_s_i_s = primwork + 176058;
139 SIMINT_DBLTYPE * const restrict PRIM_INT__m_s_k_s = primwork + 183758;
140 SIMINT_DBLTYPE * const restrict PRIM_INT__m_s_l_s = primwork + 191678;
141 SIMINT_DBLTYPE * const restrict PRIM_INT__m_s_m_s = primwork + 199103;
142 SIMINT_DBLTYPE * const restrict PRIM_INT__m_s_n_s = primwork + 205153;
143 SIMINT_DBLTYPE * const restrict PRIM_INT__n_s_s_s = primwork + 208783;
144 SIMINT_DBLTYPE * const restrict PRIM_INT__n_s_p_s = primwork + 209575;
145 SIMINT_DBLTYPE * const restrict PRIM_INT__n_s_d_s = primwork + 211555;
146 SIMINT_DBLTYPE * const restrict PRIM_INT__n_s_f_s = primwork + 215119;
147 SIMINT_DBLTYPE * const restrict PRIM_INT__n_s_g_s = primwork + 220399;
148 SIMINT_DBLTYPE * const restrict PRIM_INT__n_s_h_s = primwork + 227329;
149 SIMINT_DBLTYPE * const restrict PRIM_INT__n_s_i_s = primwork + 235645;
150 SIMINT_DBLTYPE * const restrict PRIM_INT__n_s_k_s = primwork + 244885;
151 SIMINT_DBLTYPE * const restrict PRIM_INT__n_s_l_s = primwork + 254389;
152 SIMINT_DBLTYPE * const restrict PRIM_INT__n_s_m_s = primwork + 263299;
153 SIMINT_DBLTYPE * const restrict PRIM_INT__n_s_n_s = primwork + 270559;
154 SIMINT_DBLTYPE * const restrict PRIM_INT__o_s_s_s = primwork + 274915;
155 SIMINT_DBLTYPE * const restrict PRIM_INT__o_s_p_s = primwork + 275773;
156 SIMINT_DBLTYPE * const restrict PRIM_INT__o_s_d_s = primwork + 278113;
157 SIMINT_DBLTYPE * const restrict PRIM_INT__o_s_f_s = primwork + 282325;
158 SIMINT_DBLTYPE * const restrict PRIM_INT__o_s_g_s = primwork + 288565;
159 SIMINT_DBLTYPE * const restrict PRIM_INT__o_s_h_s = primwork + 296755;
160 SIMINT_DBLTYPE * const restrict PRIM_INT__o_s_i_s = primwork + 306583;
161 SIMINT_DBLTYPE * const restrict PRIM_INT__o_s_k_s = primwork + 317503;
162 SIMINT_DBLTYPE * const restrict PRIM_INT__o_s_l_s = primwork + 328735;
163 SIMINT_DBLTYPE * const restrict PRIM_INT__o_s_m_s = primwork + 339265;
164 SIMINT_DBLTYPE * const restrict PRIM_INT__o_s_n_s = primwork + 347845;
165 double * const hrrwork = (double *)(primwork + 352993);
166 double * const HRR_INT__i_p_k_s = hrrwork + 0;
167 double * const HRR_INT__i_p_l_s = hrrwork + 3024;
168 double * const HRR_INT__i_p_m_s = hrrwork + 6804;
169 double * const HRR_INT__i_p_n_s = hrrwork + 11424;
170 double * const HRR_INT__i_d_k_s = hrrwork + 16968;
171 double * const HRR_INT__i_d_l_s = hrrwork + 23016;
172 double * const HRR_INT__i_d_m_s = hrrwork + 30576;
173 double * const HRR_INT__i_d_n_s = hrrwork + 39816;
174 double * const HRR_INT__i_f_k_s = hrrwork + 50904;
175 double * const HRR_INT__i_f_l_s = hrrwork + 60984;
176 double * const HRR_INT__i_f_m_s = hrrwork + 73584;
177 double * const HRR_INT__i_f_n_s = hrrwork + 88984;
178 double * const HRR_INT__i_g_k_s = hrrwork + 107464;
179 double * const HRR_INT__i_g_l_s = hrrwork + 122584;
180 double * const HRR_INT__i_g_m_s = hrrwork + 141484;
181 double * const HRR_INT__i_g_n_s = hrrwork + 164584;
182 double * const HRR_INT__i_h_k_s = hrrwork + 192304;
183 double * const HRR_INT__i_h_k_p = hrrwork + 213472;
184 double * const HRR_INT__i_h_k_d = hrrwork + 276976;
185 double * const HRR_INT__i_h_l_s = hrrwork + 403984;
186 double * const HRR_INT__i_h_l_p = hrrwork + 430444;
187 double * const HRR_INT__i_h_l_d = hrrwork + 509824;
188 double * const HRR_INT__i_h_m_s = hrrwork + 668584;
189 double * const HRR_INT__i_h_m_p = hrrwork + 700924;
190 double * const HRR_INT__i_h_n_s = hrrwork + 797944;
191 double * const HRR_INT__k_p_k_s = hrrwork + 836752;
192 double * const HRR_INT__k_p_l_s = hrrwork + 840640;
193 double * const HRR_INT__k_p_m_s = hrrwork + 845500;
194 double * const HRR_INT__k_p_n_s = hrrwork + 851440;
195 double * const HRR_INT__k_d_k_s = hrrwork + 858568;
196 double * const HRR_INT__k_d_l_s = hrrwork + 866344;
197 double * const HRR_INT__k_d_m_s = hrrwork + 876064;
198 double * const HRR_INT__k_d_n_s = hrrwork + 887944;
199 double * const HRR_INT__k_f_k_s = hrrwork + 902200;
200 double * const HRR_INT__k_f_l_s = hrrwork + 915160;
201 double * const HRR_INT__k_f_m_s = hrrwork + 931360;
202 double * const HRR_INT__k_f_n_s = hrrwork + 951160;
203 double * const HRR_INT__k_g_k_s = hrrwork + 974920;
204 double * const HRR_INT__k_g_l_s = hrrwork + 994360;
205 double * const HRR_INT__k_g_m_s = hrrwork + 1018660;
206 double * const HRR_INT__k_g_n_s = hrrwork + 1048360;
207 double * const HRR_INT__l_p_k_s = hrrwork + 1084000;
208 double * const HRR_INT__l_p_l_s = hrrwork + 1088860;
209 double * const HRR_INT__l_p_m_s = hrrwork + 1094935;
210 double * const HRR_INT__l_p_n_s = hrrwork + 1102360;
211 double * const HRR_INT__l_d_k_s = hrrwork + 1111270;
212 double * const HRR_INT__l_d_l_s = hrrwork + 1120990;
213 double * const HRR_INT__l_d_m_s = hrrwork + 1133140;
214 double * const HRR_INT__l_d_n_s = hrrwork + 1147990;
215 double * const HRR_INT__l_f_k_s = hrrwork + 1165810;
216 double * const HRR_INT__l_f_l_s = hrrwork + 1182010;
217 double * const HRR_INT__l_f_m_s = hrrwork + 1202260;
218 double * const HRR_INT__l_f_n_s = hrrwork + 1227010;
219 double * const HRR_INT__m_p_k_s = hrrwork + 1256710;
220 double * const HRR_INT__m_p_l_s = hrrwork + 1262650;
221 double * const HRR_INT__m_p_m_s = hrrwork + 1270075;
222 double * const HRR_INT__m_p_n_s = hrrwork + 1279150;
223 double * const HRR_INT__m_d_k_s = hrrwork + 1290040;
224 double * const HRR_INT__m_d_l_s = hrrwork + 1301920;
225 double * const HRR_INT__m_d_m_s = hrrwork + 1316770;
226 double * const HRR_INT__m_d_n_s = hrrwork + 1334920;
227 double * const HRR_INT__n_p_k_s = hrrwork + 1356700;
228 double * const HRR_INT__n_p_l_s = hrrwork + 1363828;
229 double * const HRR_INT__n_p_m_s = hrrwork + 1372738;
230 double * const HRR_INT__n_p_n_s = hrrwork + 1383628;
231
232
233 // Create constants
234 const SIMINT_DBLTYPE const_1 = SIMINT_DBLSET1(1);
235 const SIMINT_DBLTYPE const_10 = SIMINT_DBLSET1(10);
236 const SIMINT_DBLTYPE const_11 = SIMINT_DBLSET1(11);
237 const SIMINT_DBLTYPE const_2 = SIMINT_DBLSET1(2);
238 const SIMINT_DBLTYPE const_3 = SIMINT_DBLSET1(3);
239 const SIMINT_DBLTYPE const_4 = SIMINT_DBLSET1(4);
240 const SIMINT_DBLTYPE const_5 = SIMINT_DBLSET1(5);
241 const SIMINT_DBLTYPE const_6 = SIMINT_DBLSET1(6);
242 const SIMINT_DBLTYPE const_7 = SIMINT_DBLSET1(7);
243 const SIMINT_DBLTYPE const_8 = SIMINT_DBLSET1(8);
244 const SIMINT_DBLTYPE const_9 = SIMINT_DBLSET1(9);
245 const SIMINT_DBLTYPE one_half = SIMINT_DBLSET1(0.5);
246
247
248 ////////////////////////////////////////
249 // Loop over shells and primitives
250 ////////////////////////////////////////
251
252 real_abcd = 0;
253 istart = 0;
254 for(ab = 0; ab < P.nshell12_clip; ++ab)
255 {
256 const int iend = istart + P.nprim12[ab];
257
258 cd = 0;
259 jstart = 0;
260
261 for(cd = 0; cd < Q.nshell12_clip; cd += SIMINT_NSHELL_SIMD)
262 {
263 const int nshellbatch = ((cd + SIMINT_NSHELL_SIMD) > Q.nshell12_clip) ? Q.nshell12_clip - cd : SIMINT_NSHELL_SIMD;
264 int jend = jstart;
265 for(i = 0; i < nshellbatch; i++)
266 jend += Q.nprim12[cd+i];
267
268 // Clear the beginning of the workspace (where we are accumulating integrals)
269 memset(work, 0, SIMINT_NSHELL_SIMD * 62216 * sizeof(double));
270 abcd = 0;
271
272
273 for(i = istart; i < iend; ++i)
274 {
275 SIMINT_DBLTYPE bra_screen_max; // only used if check_screen
276
277 if(check_screen)
278 {
279 // Skip this whole thing if always insignificant
280 if((P.screen[i] * Q.screen_max) < screen_tol)
281 continue;
282 bra_screen_max = SIMINT_DBLSET1(P.screen[i]);
283 }
284
285 icd = 0;
286 iprimcd = 0;
287 nprim_icd = Q.nprim12[cd];
288 double * restrict PRIM_PTR_INT__i_s_k_s = INT__i_s_k_s + abcd * 1008;
289 double * restrict PRIM_PTR_INT__i_s_l_s = INT__i_s_l_s + abcd * 1260;
290 double * restrict PRIM_PTR_INT__i_s_m_s = INT__i_s_m_s + abcd * 1540;
291 double * restrict PRIM_PTR_INT__i_s_n_s = INT__i_s_n_s + abcd * 1848;
292 double * restrict PRIM_PTR_INT__k_s_k_s = INT__k_s_k_s + abcd * 1296;
293 double * restrict PRIM_PTR_INT__k_s_l_s = INT__k_s_l_s + abcd * 1620;
294 double * restrict PRIM_PTR_INT__k_s_m_s = INT__k_s_m_s + abcd * 1980;
295 double * restrict PRIM_PTR_INT__k_s_n_s = INT__k_s_n_s + abcd * 2376;
296 double * restrict PRIM_PTR_INT__l_s_k_s = INT__l_s_k_s + abcd * 1620;
297 double * restrict PRIM_PTR_INT__l_s_l_s = INT__l_s_l_s + abcd * 2025;
298 double * restrict PRIM_PTR_INT__l_s_m_s = INT__l_s_m_s + abcd * 2475;
299 double * restrict PRIM_PTR_INT__l_s_n_s = INT__l_s_n_s + abcd * 2970;
300 double * restrict PRIM_PTR_INT__m_s_k_s = INT__m_s_k_s + abcd * 1980;
301 double * restrict PRIM_PTR_INT__m_s_l_s = INT__m_s_l_s + abcd * 2475;
302 double * restrict PRIM_PTR_INT__m_s_m_s = INT__m_s_m_s + abcd * 3025;
303 double * restrict PRIM_PTR_INT__m_s_n_s = INT__m_s_n_s + abcd * 3630;
304 double * restrict PRIM_PTR_INT__n_s_k_s = INT__n_s_k_s + abcd * 2376;
305 double * restrict PRIM_PTR_INT__n_s_l_s = INT__n_s_l_s + abcd * 2970;
306 double * restrict PRIM_PTR_INT__n_s_m_s = INT__n_s_m_s + abcd * 3630;
307 double * restrict PRIM_PTR_INT__n_s_n_s = INT__n_s_n_s + abcd * 4356;
308 double * restrict PRIM_PTR_INT__o_s_k_s = INT__o_s_k_s + abcd * 2808;
309 double * restrict PRIM_PTR_INT__o_s_l_s = INT__o_s_l_s + abcd * 3510;
310 double * restrict PRIM_PTR_INT__o_s_m_s = INT__o_s_m_s + abcd * 4290;
311 double * restrict PRIM_PTR_INT__o_s_n_s = INT__o_s_n_s + abcd * 5148;
312
313
314
315 // Load these one per loop over i
316 const SIMINT_DBLTYPE P_alpha = SIMINT_DBLSET1(P.alpha[i]);
317 const SIMINT_DBLTYPE P_prefac = SIMINT_DBLSET1(P.prefac[i]);
318 const SIMINT_DBLTYPE Pxyz[3] = { SIMINT_DBLSET1(P.x[i]), SIMINT_DBLSET1(P.y[i]), SIMINT_DBLSET1(P.z[i]) };
319
320 const SIMINT_DBLTYPE P_PA[3] = { SIMINT_DBLSET1(P.PA_x[i]), SIMINT_DBLSET1(P.PA_y[i]), SIMINT_DBLSET1(P.PA_z[i]) };
321
322 for(j = jstart; j < jend; j += SIMINT_SIMD_LEN)
323 {
324 // calculate the shell offsets
325 // these are the offset from the shell pointed to by cd
326 // for each element
327 int shelloffsets[SIMINT_SIMD_LEN] = {0};
328 int lastoffset = 0;
329 const int nlane = ( ((j + SIMINT_SIMD_LEN) < jend) ? SIMINT_SIMD_LEN : (jend - j));
330
331 if((iprimcd + SIMINT_SIMD_LEN) >= nprim_icd)
332 {
333 // Handle if the first element of the vector is a new shell
334 if(iprimcd >= nprim_icd && ((icd+1) < nshellbatch))
335 {
336 nprim_icd += Q.nprim12[cd + (++icd)];
337 PRIM_PTR_INT__i_s_k_s += 1008;
338 PRIM_PTR_INT__i_s_l_s += 1260;
339 PRIM_PTR_INT__i_s_m_s += 1540;
340 PRIM_PTR_INT__i_s_n_s += 1848;
341 PRIM_PTR_INT__k_s_k_s += 1296;
342 PRIM_PTR_INT__k_s_l_s += 1620;
343 PRIM_PTR_INT__k_s_m_s += 1980;
344 PRIM_PTR_INT__k_s_n_s += 2376;
345 PRIM_PTR_INT__l_s_k_s += 1620;
346 PRIM_PTR_INT__l_s_l_s += 2025;
347 PRIM_PTR_INT__l_s_m_s += 2475;
348 PRIM_PTR_INT__l_s_n_s += 2970;
349 PRIM_PTR_INT__m_s_k_s += 1980;
350 PRIM_PTR_INT__m_s_l_s += 2475;
351 PRIM_PTR_INT__m_s_m_s += 3025;
352 PRIM_PTR_INT__m_s_n_s += 3630;
353 PRIM_PTR_INT__n_s_k_s += 2376;
354 PRIM_PTR_INT__n_s_l_s += 2970;
355 PRIM_PTR_INT__n_s_m_s += 3630;
356 PRIM_PTR_INT__n_s_n_s += 4356;
357 PRIM_PTR_INT__o_s_k_s += 2808;
358 PRIM_PTR_INT__o_s_l_s += 3510;
359 PRIM_PTR_INT__o_s_m_s += 4290;
360 PRIM_PTR_INT__o_s_n_s += 5148;
361 }
362 iprimcd++;
363 for(n = 1; n < SIMINT_SIMD_LEN; ++n)
364 {
365 if(iprimcd >= nprim_icd && ((icd+1) < nshellbatch))
366 {
367 shelloffsets[n] = shelloffsets[n-1] + 1;
368 lastoffset++;
369 nprim_icd += Q.nprim12[cd + (++icd)];
370 }
371 else
372 shelloffsets[n] = shelloffsets[n-1];
373 iprimcd++;
374 }
375 }
376 else
377 iprimcd += SIMINT_SIMD_LEN;
378
379 // Do we have to compute this vector (or has it been screened out)?
380 // (not_screened != 0 means we have to do this vector)
381 if(check_screen)
382 {
383 const double vmax = vector_max(SIMINT_MUL(bra_screen_max, SIMINT_DBLLOAD(Q.screen, j)));
384 if(vmax < screen_tol)
385 {
386 PRIM_PTR_INT__i_s_k_s += lastoffset*1008;
387 PRIM_PTR_INT__i_s_l_s += lastoffset*1260;
388 PRIM_PTR_INT__i_s_m_s += lastoffset*1540;
389 PRIM_PTR_INT__i_s_n_s += lastoffset*1848;
390 PRIM_PTR_INT__k_s_k_s += lastoffset*1296;
391 PRIM_PTR_INT__k_s_l_s += lastoffset*1620;
392 PRIM_PTR_INT__k_s_m_s += lastoffset*1980;
393 PRIM_PTR_INT__k_s_n_s += lastoffset*2376;
394 PRIM_PTR_INT__l_s_k_s += lastoffset*1620;
395 PRIM_PTR_INT__l_s_l_s += lastoffset*2025;
396 PRIM_PTR_INT__l_s_m_s += lastoffset*2475;
397 PRIM_PTR_INT__l_s_n_s += lastoffset*2970;
398 PRIM_PTR_INT__m_s_k_s += lastoffset*1980;
399 PRIM_PTR_INT__m_s_l_s += lastoffset*2475;
400 PRIM_PTR_INT__m_s_m_s += lastoffset*3025;
401 PRIM_PTR_INT__m_s_n_s += lastoffset*3630;
402 PRIM_PTR_INT__n_s_k_s += lastoffset*2376;
403 PRIM_PTR_INT__n_s_l_s += lastoffset*2970;
404 PRIM_PTR_INT__n_s_m_s += lastoffset*3630;
405 PRIM_PTR_INT__n_s_n_s += lastoffset*4356;
406 PRIM_PTR_INT__o_s_k_s += lastoffset*2808;
407 PRIM_PTR_INT__o_s_l_s += lastoffset*3510;
408 PRIM_PTR_INT__o_s_m_s += lastoffset*4290;
409 PRIM_PTR_INT__o_s_n_s += lastoffset*5148;
410 continue;
411 }
412 }
413
414 const SIMINT_DBLTYPE Q_alpha = SIMINT_DBLLOAD(Q.alpha, j);
415 const SIMINT_DBLTYPE PQalpha_mul = SIMINT_MUL(P_alpha, Q_alpha);
416 const SIMINT_DBLTYPE PQalpha_sum = SIMINT_ADD(P_alpha, Q_alpha);
417 const SIMINT_DBLTYPE one_over_PQalpha_sum = SIMINT_DIV(const_1, PQalpha_sum);
418
419
420 /* construct R2 = (Px - Qx)**2 + (Py - Qy)**2 + (Pz -Qz)**2 */
421 SIMINT_DBLTYPE PQ[3];
422 PQ[0] = SIMINT_SUB(Pxyz[0], SIMINT_DBLLOAD(Q.x, j));
423 PQ[1] = SIMINT_SUB(Pxyz[1], SIMINT_DBLLOAD(Q.y, j));
424 PQ[2] = SIMINT_SUB(Pxyz[2], SIMINT_DBLLOAD(Q.z, j));
425 SIMINT_DBLTYPE R2 = SIMINT_MUL(PQ[0], PQ[0]);
426 R2 = SIMINT_FMADD(PQ[1], PQ[1], R2);
427 R2 = SIMINT_FMADD(PQ[2], PQ[2], R2);
428
429 const SIMINT_DBLTYPE alpha = SIMINT_MUL(PQalpha_mul, one_over_PQalpha_sum); // alpha from MEST
430 const SIMINT_DBLTYPE one_over_p = SIMINT_DIV(const_1, P_alpha);
431 const SIMINT_DBLTYPE one_over_q = SIMINT_DIV(const_1, Q_alpha);
432 const SIMINT_DBLTYPE one_over_2p = SIMINT_MUL(one_half, one_over_p);
433 const SIMINT_DBLTYPE one_over_2q = SIMINT_MUL(one_half, one_over_q);
434 const SIMINT_DBLTYPE one_over_2pq = SIMINT_MUL(one_half, one_over_PQalpha_sum);
435 const SIMINT_DBLTYPE Q_PA[3] = { SIMINT_DBLLOAD(Q.PA_x, j), SIMINT_DBLLOAD(Q.PA_y, j), SIMINT_DBLLOAD(Q.PA_z, j) };
436
437 // NOTE: Minus sign!
438 const SIMINT_DBLTYPE a_over_p = SIMINT_MUL(SIMINT_NEG(alpha), one_over_p);
439 SIMINT_DBLTYPE aop_PQ[3];
440 aop_PQ[0] = SIMINT_MUL(a_over_p, PQ[0]);
441 aop_PQ[1] = SIMINT_MUL(a_over_p, PQ[1]);
442 aop_PQ[2] = SIMINT_MUL(a_over_p, PQ[2]);
443
444 SIMINT_DBLTYPE a_over_q = SIMINT_MUL(alpha, one_over_q);
445 SIMINT_DBLTYPE aoq_PQ[3];
446 aoq_PQ[0] = SIMINT_MUL(a_over_q, PQ[0]);
447 aoq_PQ[1] = SIMINT_MUL(a_over_q, PQ[1]);
448 aoq_PQ[2] = SIMINT_MUL(a_over_q, PQ[2]);
449 // Put a minus sign here so we don't have to in RR routines
450 a_over_q = SIMINT_NEG(a_over_q);
451
452
453 //////////////////////////////////////////////
454 // Fjt function section
455 // Maximum v value: 21
456 //////////////////////////////////////////////
457 // The parameter to the Fjt function
458 const SIMINT_DBLTYPE F_x = SIMINT_MUL(R2, alpha);
459
460
461 const SIMINT_DBLTYPE Q_prefac = mask_load(nlane, Q.prefac + j);
462
463
464 boys_F_split(PRIM_INT__s_s_s_s, F_x, 21);
465 SIMINT_DBLTYPE prefac = SIMINT_SQRT(one_over_PQalpha_sum);
466 prefac = SIMINT_MUL(SIMINT_MUL(P_prefac, Q_prefac), prefac);
467 for(n = 0; n <= 21; n++)
468 PRIM_INT__s_s_s_s[n] = SIMINT_MUL(PRIM_INT__s_s_s_s[n], prefac);
469
470 //////////////////////////////////////////////
471 // Primitive integrals: Vertical recurrance
472 //////////////////////////////////////////////
473
474 const SIMINT_DBLTYPE vrr_const_1_over_2p = one_over_2p;
475 const SIMINT_DBLTYPE vrr_const_2_over_2p = SIMINT_MUL(const_2, one_over_2p);
476 const SIMINT_DBLTYPE vrr_const_3_over_2p = SIMINT_MUL(const_3, one_over_2p);
477 const SIMINT_DBLTYPE vrr_const_4_over_2p = SIMINT_MUL(const_4, one_over_2p);
478 const SIMINT_DBLTYPE vrr_const_5_over_2p = SIMINT_MUL(const_5, one_over_2p);
479 const SIMINT_DBLTYPE vrr_const_6_over_2p = SIMINT_MUL(const_6, one_over_2p);
480 const SIMINT_DBLTYPE vrr_const_7_over_2p = SIMINT_MUL(const_7, one_over_2p);
481 const SIMINT_DBLTYPE vrr_const_8_over_2p = SIMINT_MUL(const_8, one_over_2p);
482 const SIMINT_DBLTYPE vrr_const_9_over_2p = SIMINT_MUL(const_9, one_over_2p);
483 const SIMINT_DBLTYPE vrr_const_10_over_2p = SIMINT_MUL(const_10, one_over_2p);
484 const SIMINT_DBLTYPE vrr_const_1_over_2q = one_over_2q;
485 const SIMINT_DBLTYPE vrr_const_2_over_2q = SIMINT_MUL(const_2, one_over_2q);
486 const SIMINT_DBLTYPE vrr_const_3_over_2q = SIMINT_MUL(const_3, one_over_2q);
487 const SIMINT_DBLTYPE vrr_const_4_over_2q = SIMINT_MUL(const_4, one_over_2q);
488 const SIMINT_DBLTYPE vrr_const_5_over_2q = SIMINT_MUL(const_5, one_over_2q);
489 const SIMINT_DBLTYPE vrr_const_6_over_2q = SIMINT_MUL(const_6, one_over_2q);
490 const SIMINT_DBLTYPE vrr_const_7_over_2q = SIMINT_MUL(const_7, one_over_2q);
491 const SIMINT_DBLTYPE vrr_const_8_over_2q = SIMINT_MUL(const_8, one_over_2q);
492 const SIMINT_DBLTYPE vrr_const_9_over_2q = SIMINT_MUL(const_9, one_over_2q);
493 const SIMINT_DBLTYPE vrr_const_1_over_2pq = one_over_2pq;
494 const SIMINT_DBLTYPE vrr_const_2_over_2pq = SIMINT_MUL(const_2, one_over_2pq);
495 const SIMINT_DBLTYPE vrr_const_3_over_2pq = SIMINT_MUL(const_3, one_over_2pq);
496 const SIMINT_DBLTYPE vrr_const_4_over_2pq = SIMINT_MUL(const_4, one_over_2pq);
497 const SIMINT_DBLTYPE vrr_const_5_over_2pq = SIMINT_MUL(const_5, one_over_2pq);
498 const SIMINT_DBLTYPE vrr_const_6_over_2pq = SIMINT_MUL(const_6, one_over_2pq);
499 const SIMINT_DBLTYPE vrr_const_7_over_2pq = SIMINT_MUL(const_7, one_over_2pq);
500 const SIMINT_DBLTYPE vrr_const_8_over_2pq = SIMINT_MUL(const_8, one_over_2pq);
501 const SIMINT_DBLTYPE vrr_const_9_over_2pq = SIMINT_MUL(const_9, one_over_2pq);
502 const SIMINT_DBLTYPE vrr_const_10_over_2pq = SIMINT_MUL(const_10, one_over_2pq);
503 const SIMINT_DBLTYPE vrr_const_11_over_2pq = SIMINT_MUL(const_11, one_over_2pq);
504
505
506
507 // Forming PRIM_INT__p_s_s_s[21 * 3];
508 for(n = 0; n < 21; ++n) // loop over orders of auxiliary function
509 {
510
511 PRIM_INT__p_s_s_s[n * 3 + 0] = SIMINT_MUL(P_PA[0], PRIM_INT__s_s_s_s[n * 1 + 0]);
512 PRIM_INT__p_s_s_s[n * 3 + 0] = SIMINT_FMADD( aop_PQ[0], PRIM_INT__s_s_s_s[(n+1) * 1 + 0], PRIM_INT__p_s_s_s[n * 3 + 0]);
513
514 PRIM_INT__p_s_s_s[n * 3 + 1] = SIMINT_MUL(P_PA[1], PRIM_INT__s_s_s_s[n * 1 + 0]);
515 PRIM_INT__p_s_s_s[n * 3 + 1] = SIMINT_FMADD( aop_PQ[1], PRIM_INT__s_s_s_s[(n+1) * 1 + 0], PRIM_INT__p_s_s_s[n * 3 + 1]);
516
517 PRIM_INT__p_s_s_s[n * 3 + 2] = SIMINT_MUL(P_PA[2], PRIM_INT__s_s_s_s[n * 1 + 0]);
518 PRIM_INT__p_s_s_s[n * 3 + 2] = SIMINT_FMADD( aop_PQ[2], PRIM_INT__s_s_s_s[(n+1) * 1 + 0], PRIM_INT__p_s_s_s[n * 3 + 2]);
519
520 }
521
522
523
524 // Forming PRIM_INT__d_s_s_s[20 * 6];
525 for(n = 0; n < 20; ++n) // loop over orders of auxiliary function
526 {
527
528 PRIM_INT__d_s_s_s[n * 6 + 0] = SIMINT_MUL(P_PA[0], PRIM_INT__p_s_s_s[n * 3 + 0]);
529 PRIM_INT__d_s_s_s[n * 6 + 0] = SIMINT_FMADD( aop_PQ[0], PRIM_INT__p_s_s_s[(n+1) * 3 + 0], PRIM_INT__d_s_s_s[n * 6 + 0]);
530 PRIM_INT__d_s_s_s[n * 6 + 0] = SIMINT_FMADD( vrr_const_1_over_2p, SIMINT_FMADD(a_over_p, PRIM_INT__s_s_s_s[(n+1) * 1 + 0], PRIM_INT__s_s_s_s[n * 1 + 0]), PRIM_INT__d_s_s_s[n * 6 + 0]);
531
532 PRIM_INT__d_s_s_s[n * 6 + 1] = SIMINT_MUL(P_PA[1], PRIM_INT__p_s_s_s[n * 3 + 0]);
533 PRIM_INT__d_s_s_s[n * 6 + 1] = SIMINT_FMADD( aop_PQ[1], PRIM_INT__p_s_s_s[(n+1) * 3 + 0], PRIM_INT__d_s_s_s[n * 6 + 1]);
534
535 PRIM_INT__d_s_s_s[n * 6 + 2] = SIMINT_MUL(P_PA[2], PRIM_INT__p_s_s_s[n * 3 + 0]);
536 PRIM_INT__d_s_s_s[n * 6 + 2] = SIMINT_FMADD( aop_PQ[2], PRIM_INT__p_s_s_s[(n+1) * 3 + 0], PRIM_INT__d_s_s_s[n * 6 + 2]);
537
538 PRIM_INT__d_s_s_s[n * 6 + 3] = SIMINT_MUL(P_PA[1], PRIM_INT__p_s_s_s[n * 3 + 1]);
539 PRIM_INT__d_s_s_s[n * 6 + 3] = SIMINT_FMADD( aop_PQ[1], PRIM_INT__p_s_s_s[(n+1) * 3 + 1], PRIM_INT__d_s_s_s[n * 6 + 3]);
540 PRIM_INT__d_s_s_s[n * 6 + 3] = SIMINT_FMADD( vrr_const_1_over_2p, SIMINT_FMADD(a_over_p, PRIM_INT__s_s_s_s[(n+1) * 1 + 0], PRIM_INT__s_s_s_s[n * 1 + 0]), PRIM_INT__d_s_s_s[n * 6 + 3]);
541
542 PRIM_INT__d_s_s_s[n * 6 + 4] = SIMINT_MUL(P_PA[2], PRIM_INT__p_s_s_s[n * 3 + 1]);
543 PRIM_INT__d_s_s_s[n * 6 + 4] = SIMINT_FMADD( aop_PQ[2], PRIM_INT__p_s_s_s[(n+1) * 3 + 1], PRIM_INT__d_s_s_s[n * 6 + 4]);
544
545 PRIM_INT__d_s_s_s[n * 6 + 5] = SIMINT_MUL(P_PA[2], PRIM_INT__p_s_s_s[n * 3 + 2]);
546 PRIM_INT__d_s_s_s[n * 6 + 5] = SIMINT_FMADD( aop_PQ[2], PRIM_INT__p_s_s_s[(n+1) * 3 + 2], PRIM_INT__d_s_s_s[n * 6 + 5]);
547 PRIM_INT__d_s_s_s[n * 6 + 5] = SIMINT_FMADD( vrr_const_1_over_2p, SIMINT_FMADD(a_over_p, PRIM_INT__s_s_s_s[(n+1) * 1 + 0], PRIM_INT__s_s_s_s[n * 1 + 0]), PRIM_INT__d_s_s_s[n * 6 + 5]);
548
549 }
550
551
552
553 // Forming PRIM_INT__f_s_s_s[19 * 10];
554 for(n = 0; n < 19; ++n) // loop over orders of auxiliary function
555 {
556
557 PRIM_INT__f_s_s_s[n * 10 + 0] = SIMINT_MUL(P_PA[0], PRIM_INT__d_s_s_s[n * 6 + 0]);
558 PRIM_INT__f_s_s_s[n * 10 + 0] = SIMINT_FMADD( aop_PQ[0], PRIM_INT__d_s_s_s[(n+1) * 6 + 0], PRIM_INT__f_s_s_s[n * 10 + 0]);
559 PRIM_INT__f_s_s_s[n * 10 + 0] = SIMINT_FMADD( vrr_const_2_over_2p, SIMINT_FMADD(a_over_p, PRIM_INT__p_s_s_s[(n+1) * 3 + 0], PRIM_INT__p_s_s_s[n * 3 + 0]), PRIM_INT__f_s_s_s[n * 10 + 0]);
560
561 PRIM_INT__f_s_s_s[n * 10 + 1] = SIMINT_MUL(P_PA[1], PRIM_INT__d_s_s_s[n * 6 + 0]);
562 PRIM_INT__f_s_s_s[n * 10 + 1] = SIMINT_FMADD( aop_PQ[1], PRIM_INT__d_s_s_s[(n+1) * 6 + 0], PRIM_INT__f_s_s_s[n * 10 + 1]);
563
564 PRIM_INT__f_s_s_s[n * 10 + 2] = SIMINT_MUL(P_PA[2], PRIM_INT__d_s_s_s[n * 6 + 0]);
565 PRIM_INT__f_s_s_s[n * 10 + 2] = SIMINT_FMADD( aop_PQ[2], PRIM_INT__d_s_s_s[(n+1) * 6 + 0], PRIM_INT__f_s_s_s[n * 10 + 2]);
566
567 PRIM_INT__f_s_s_s[n * 10 + 3] = SIMINT_MUL(P_PA[0], PRIM_INT__d_s_s_s[n * 6 + 3]);
568 PRIM_INT__f_s_s_s[n * 10 + 3] = SIMINT_FMADD( aop_PQ[0], PRIM_INT__d_s_s_s[(n+1) * 6 + 3], PRIM_INT__f_s_s_s[n * 10 + 3]);
569
570 PRIM_INT__f_s_s_s[n * 10 + 4] = SIMINT_MUL(P_PA[2], PRIM_INT__d_s_s_s[n * 6 + 1]);
571 PRIM_INT__f_s_s_s[n * 10 + 4] = SIMINT_FMADD( aop_PQ[2], PRIM_INT__d_s_s_s[(n+1) * 6 + 1], PRIM_INT__f_s_s_s[n * 10 + 4]);
572
573 PRIM_INT__f_s_s_s[n * 10 + 5] = SIMINT_MUL(P_PA[0], PRIM_INT__d_s_s_s[n * 6 + 5]);
574 PRIM_INT__f_s_s_s[n * 10 + 5] = SIMINT_FMADD( aop_PQ[0], PRIM_INT__d_s_s_s[(n+1) * 6 + 5], PRIM_INT__f_s_s_s[n * 10 + 5]);
575
576 PRIM_INT__f_s_s_s[n * 10 + 6] = SIMINT_MUL(P_PA[1], PRIM_INT__d_s_s_s[n * 6 + 3]);
577 PRIM_INT__f_s_s_s[n * 10 + 6] = SIMINT_FMADD( aop_PQ[1], PRIM_INT__d_s_s_s[(n+1) * 6 + 3], PRIM_INT__f_s_s_s[n * 10 + 6]);
578 PRIM_INT__f_s_s_s[n * 10 + 6] = SIMINT_FMADD( vrr_const_2_over_2p, SIMINT_FMADD(a_over_p, PRIM_INT__p_s_s_s[(n+1) * 3 + 1], PRIM_INT__p_s_s_s[n * 3 + 1]), PRIM_INT__f_s_s_s[n * 10 + 6]);
579
580 PRIM_INT__f_s_s_s[n * 10 + 7] = SIMINT_MUL(P_PA[2], PRIM_INT__d_s_s_s[n * 6 + 3]);
581 PRIM_INT__f_s_s_s[n * 10 + 7] = SIMINT_FMADD( aop_PQ[2], PRIM_INT__d_s_s_s[(n+1) * 6 + 3], PRIM_INT__f_s_s_s[n * 10 + 7]);
582
583 PRIM_INT__f_s_s_s[n * 10 + 8] = SIMINT_MUL(P_PA[1], PRIM_INT__d_s_s_s[n * 6 + 5]);
584 PRIM_INT__f_s_s_s[n * 10 + 8] = SIMINT_FMADD( aop_PQ[1], PRIM_INT__d_s_s_s[(n+1) * 6 + 5], PRIM_INT__f_s_s_s[n * 10 + 8]);
585
586 PRIM_INT__f_s_s_s[n * 10 + 9] = SIMINT_MUL(P_PA[2], PRIM_INT__d_s_s_s[n * 6 + 5]);
587 PRIM_INT__f_s_s_s[n * 10 + 9] = SIMINT_FMADD( aop_PQ[2], PRIM_INT__d_s_s_s[(n+1) * 6 + 5], PRIM_INT__f_s_s_s[n * 10 + 9]);
588 PRIM_INT__f_s_s_s[n * 10 + 9] = SIMINT_FMADD( vrr_const_2_over_2p, SIMINT_FMADD(a_over_p, PRIM_INT__p_s_s_s[(n+1) * 3 + 2], PRIM_INT__p_s_s_s[n * 3 + 2]), PRIM_INT__f_s_s_s[n * 10 + 9]);
589
590 }
591
592
593 VRR_I_g_s_s_s(
594 PRIM_INT__g_s_s_s,
595 PRIM_INT__f_s_s_s,
596 PRIM_INT__d_s_s_s,
597 P_PA,
598 a_over_p,
599 aop_PQ,
600 one_over_2p,
601 18);
602
603
604 VRR_I_h_s_s_s(
605 PRIM_INT__h_s_s_s,
606 PRIM_INT__g_s_s_s,
607 PRIM_INT__f_s_s_s,
608 P_PA,
609 a_over_p,
610 aop_PQ,
611 one_over_2p,
612 17);
613
614
615 ostei_general_vrr1_I(6, 16,
616 one_over_2p, a_over_p, aop_PQ, P_PA,
617 PRIM_INT__h_s_s_s, PRIM_INT__g_s_s_s, PRIM_INT__i_s_s_s);
618
619
620 ostei_general_vrr_K(6, 0, 1, 0, 10,
621 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
622 PRIM_INT__i_s_s_s, NULL, NULL, PRIM_INT__h_s_s_s, NULL, PRIM_INT__i_s_p_s);
623
624
625 ostei_general_vrr_K(5, 0, 1, 0, 10,
626 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
627 PRIM_INT__h_s_s_s, NULL, NULL, PRIM_INT__g_s_s_s, NULL, PRIM_INT__h_s_p_s);
628
629
630 ostei_general_vrr_K(6, 0, 2, 0, 9,
631 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
632 PRIM_INT__i_s_p_s, PRIM_INT__i_s_s_s, NULL, PRIM_INT__h_s_p_s, NULL, PRIM_INT__i_s_d_s);
633
634
635 VRR_K_g_s_p_s(
636 PRIM_INT__g_s_p_s,
637 PRIM_INT__g_s_s_s,
638 PRIM_INT__f_s_s_s,
639 Q_PA,
640 aoq_PQ,
641 one_over_2pq,
642 10);
643
644
645 ostei_general_vrr_K(5, 0, 2, 0, 9,
646 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
647 PRIM_INT__h_s_p_s, PRIM_INT__h_s_s_s, NULL, PRIM_INT__g_s_p_s, NULL, PRIM_INT__h_s_d_s);
648
649
650 ostei_general_vrr_K(6, 0, 3, 0, 8,
651 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
652 PRIM_INT__i_s_d_s, PRIM_INT__i_s_p_s, NULL, PRIM_INT__h_s_d_s, NULL, PRIM_INT__i_s_f_s);
653
654
655 VRR_K_f_s_p_s(
656 PRIM_INT__f_s_p_s,
657 PRIM_INT__f_s_s_s,
658 PRIM_INT__d_s_s_s,
659 Q_PA,
660 aoq_PQ,
661 one_over_2pq,
662 10);
663
664
665 ostei_general_vrr_K(4, 0, 2, 0, 9,
666 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
667 PRIM_INT__g_s_p_s, PRIM_INT__g_s_s_s, NULL, PRIM_INT__f_s_p_s, NULL, PRIM_INT__g_s_d_s);
668
669
670 ostei_general_vrr_K(5, 0, 3, 0, 8,
671 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
672 PRIM_INT__h_s_d_s, PRIM_INT__h_s_p_s, NULL, PRIM_INT__g_s_d_s, NULL, PRIM_INT__h_s_f_s);
673
674
675 ostei_general_vrr_K(6, 0, 4, 0, 7,
676 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
677 PRIM_INT__i_s_f_s, PRIM_INT__i_s_d_s, NULL, PRIM_INT__h_s_f_s, NULL, PRIM_INT__i_s_g_s);
678
679
680
681 // Forming PRIM_INT__d_s_p_s[10 * 18];
682 for(n = 0; n < 10; ++n) // loop over orders of auxiliary function
683 {
684
685 PRIM_INT__d_s_p_s[n * 18 + 0] = SIMINT_MUL(Q_PA[0], PRIM_INT__d_s_s_s[n * 6 + 0]);
686 PRIM_INT__d_s_p_s[n * 18 + 0] = SIMINT_FMADD( aoq_PQ[0], PRIM_INT__d_s_s_s[(n+1) * 6 + 0], PRIM_INT__d_s_p_s[n * 18 + 0]);
687 PRIM_INT__d_s_p_s[n * 18 + 0] = SIMINT_FMADD( vrr_const_2_over_2pq, PRIM_INT__p_s_s_s[(n+1) * 3 + 0], PRIM_INT__d_s_p_s[n * 18 + 0]);
688
689 PRIM_INT__d_s_p_s[n * 18 + 1] = SIMINT_MUL(Q_PA[1], PRIM_INT__d_s_s_s[n * 6 + 0]);
690 PRIM_INT__d_s_p_s[n * 18 + 1] = SIMINT_FMADD( aoq_PQ[1], PRIM_INT__d_s_s_s[(n+1) * 6 + 0], PRIM_INT__d_s_p_s[n * 18 + 1]);
691
692 PRIM_INT__d_s_p_s[n * 18 + 2] = SIMINT_MUL(Q_PA[2], PRIM_INT__d_s_s_s[n * 6 + 0]);
693 PRIM_INT__d_s_p_s[n * 18 + 2] = SIMINT_FMADD( aoq_PQ[2], PRIM_INT__d_s_s_s[(n+1) * 6 + 0], PRIM_INT__d_s_p_s[n * 18 + 2]);
694
695 PRIM_INT__d_s_p_s[n * 18 + 3] = SIMINT_MUL(Q_PA[0], PRIM_INT__d_s_s_s[n * 6 + 1]);
696 PRIM_INT__d_s_p_s[n * 18 + 3] = SIMINT_FMADD( aoq_PQ[0], PRIM_INT__d_s_s_s[(n+1) * 6 + 1], PRIM_INT__d_s_p_s[n * 18 + 3]);
697 PRIM_INT__d_s_p_s[n * 18 + 3] = SIMINT_FMADD( vrr_const_1_over_2pq, PRIM_INT__p_s_s_s[(n+1) * 3 + 1], PRIM_INT__d_s_p_s[n * 18 + 3]);
698
699 PRIM_INT__d_s_p_s[n * 18 + 4] = SIMINT_MUL(Q_PA[1], PRIM_INT__d_s_s_s[n * 6 + 1]);
700 PRIM_INT__d_s_p_s[n * 18 + 4] = SIMINT_FMADD( aoq_PQ[1], PRIM_INT__d_s_s_s[(n+1) * 6 + 1], PRIM_INT__d_s_p_s[n * 18 + 4]);
701 PRIM_INT__d_s_p_s[n * 18 + 4] = SIMINT_FMADD( vrr_const_1_over_2pq, PRIM_INT__p_s_s_s[(n+1) * 3 + 0], PRIM_INT__d_s_p_s[n * 18 + 4]);
702
703 PRIM_INT__d_s_p_s[n * 18 + 5] = SIMINT_MUL(Q_PA[2], PRIM_INT__d_s_s_s[n * 6 + 1]);
704 PRIM_INT__d_s_p_s[n * 18 + 5] = SIMINT_FMADD( aoq_PQ[2], PRIM_INT__d_s_s_s[(n+1) * 6 + 1], PRIM_INT__d_s_p_s[n * 18 + 5]);
705
706 PRIM_INT__d_s_p_s[n * 18 + 6] = SIMINT_MUL(Q_PA[0], PRIM_INT__d_s_s_s[n * 6 + 2]);
707 PRIM_INT__d_s_p_s[n * 18 + 6] = SIMINT_FMADD( aoq_PQ[0], PRIM_INT__d_s_s_s[(n+1) * 6 + 2], PRIM_INT__d_s_p_s[n * 18 + 6]);
708 PRIM_INT__d_s_p_s[n * 18 + 6] = SIMINT_FMADD( vrr_const_1_over_2pq, PRIM_INT__p_s_s_s[(n+1) * 3 + 2], PRIM_INT__d_s_p_s[n * 18 + 6]);
709
710 PRIM_INT__d_s_p_s[n * 18 + 7] = SIMINT_MUL(Q_PA[1], PRIM_INT__d_s_s_s[n * 6 + 2]);
711 PRIM_INT__d_s_p_s[n * 18 + 7] = SIMINT_FMADD( aoq_PQ[1], PRIM_INT__d_s_s_s[(n+1) * 6 + 2], PRIM_INT__d_s_p_s[n * 18 + 7]);
712
713 PRIM_INT__d_s_p_s[n * 18 + 8] = SIMINT_MUL(Q_PA[2], PRIM_INT__d_s_s_s[n * 6 + 2]);
714 PRIM_INT__d_s_p_s[n * 18 + 8] = SIMINT_FMADD( aoq_PQ[2], PRIM_INT__d_s_s_s[(n+1) * 6 + 2], PRIM_INT__d_s_p_s[n * 18 + 8]);
715 PRIM_INT__d_s_p_s[n * 18 + 8] = SIMINT_FMADD( vrr_const_1_over_2pq, PRIM_INT__p_s_s_s[(n+1) * 3 + 0], PRIM_INT__d_s_p_s[n * 18 + 8]);
716
717 PRIM_INT__d_s_p_s[n * 18 + 9] = SIMINT_MUL(Q_PA[0], PRIM_INT__d_s_s_s[n * 6 + 3]);
718 PRIM_INT__d_s_p_s[n * 18 + 9] = SIMINT_FMADD( aoq_PQ[0], PRIM_INT__d_s_s_s[(n+1) * 6 + 3], PRIM_INT__d_s_p_s[n * 18 + 9]);
719
720 PRIM_INT__d_s_p_s[n * 18 + 10] = SIMINT_MUL(Q_PA[1], PRIM_INT__d_s_s_s[n * 6 + 3]);
721 PRIM_INT__d_s_p_s[n * 18 + 10] = SIMINT_FMADD( aoq_PQ[1], PRIM_INT__d_s_s_s[(n+1) * 6 + 3], PRIM_INT__d_s_p_s[n * 18 + 10]);
722 PRIM_INT__d_s_p_s[n * 18 + 10] = SIMINT_FMADD( vrr_const_2_over_2pq, PRIM_INT__p_s_s_s[(n+1) * 3 + 1], PRIM_INT__d_s_p_s[n * 18 + 10]);
723
724 PRIM_INT__d_s_p_s[n * 18 + 11] = SIMINT_MUL(Q_PA[2], PRIM_INT__d_s_s_s[n * 6 + 3]);
725 PRIM_INT__d_s_p_s[n * 18 + 11] = SIMINT_FMADD( aoq_PQ[2], PRIM_INT__d_s_s_s[(n+1) * 6 + 3], PRIM_INT__d_s_p_s[n * 18 + 11]);
726
727 PRIM_INT__d_s_p_s[n * 18 + 12] = SIMINT_MUL(Q_PA[0], PRIM_INT__d_s_s_s[n * 6 + 4]);
728 PRIM_INT__d_s_p_s[n * 18 + 12] = SIMINT_FMADD( aoq_PQ[0], PRIM_INT__d_s_s_s[(n+1) * 6 + 4], PRIM_INT__d_s_p_s[n * 18 + 12]);
729
730 PRIM_INT__d_s_p_s[n * 18 + 13] = SIMINT_MUL(Q_PA[1], PRIM_INT__d_s_s_s[n * 6 + 4]);
731 PRIM_INT__d_s_p_s[n * 18 + 13] = SIMINT_FMADD( aoq_PQ[1], PRIM_INT__d_s_s_s[(n+1) * 6 + 4], PRIM_INT__d_s_p_s[n * 18 + 13]);
732 PRIM_INT__d_s_p_s[n * 18 + 13] = SIMINT_FMADD( vrr_const_1_over_2pq, PRIM_INT__p_s_s_s[(n+1) * 3 + 2], PRIM_INT__d_s_p_s[n * 18 + 13]);
733
734 PRIM_INT__d_s_p_s[n * 18 + 14] = SIMINT_MUL(Q_PA[2], PRIM_INT__d_s_s_s[n * 6 + 4]);
735 PRIM_INT__d_s_p_s[n * 18 + 14] = SIMINT_FMADD( aoq_PQ[2], PRIM_INT__d_s_s_s[(n+1) * 6 + 4], PRIM_INT__d_s_p_s[n * 18 + 14]);
736 PRIM_INT__d_s_p_s[n * 18 + 14] = SIMINT_FMADD( vrr_const_1_over_2pq, PRIM_INT__p_s_s_s[(n+1) * 3 + 1], PRIM_INT__d_s_p_s[n * 18 + 14]);
737
738 PRIM_INT__d_s_p_s[n * 18 + 15] = SIMINT_MUL(Q_PA[0], PRIM_INT__d_s_s_s[n * 6 + 5]);
739 PRIM_INT__d_s_p_s[n * 18 + 15] = SIMINT_FMADD( aoq_PQ[0], PRIM_INT__d_s_s_s[(n+1) * 6 + 5], PRIM_INT__d_s_p_s[n * 18 + 15]);
740
741 PRIM_INT__d_s_p_s[n * 18 + 16] = SIMINT_MUL(Q_PA[1], PRIM_INT__d_s_s_s[n * 6 + 5]);
742 PRIM_INT__d_s_p_s[n * 18 + 16] = SIMINT_FMADD( aoq_PQ[1], PRIM_INT__d_s_s_s[(n+1) * 6 + 5], PRIM_INT__d_s_p_s[n * 18 + 16]);
743
744 PRIM_INT__d_s_p_s[n * 18 + 17] = SIMINT_MUL(Q_PA[2], PRIM_INT__d_s_s_s[n * 6 + 5]);
745 PRIM_INT__d_s_p_s[n * 18 + 17] = SIMINT_FMADD( aoq_PQ[2], PRIM_INT__d_s_s_s[(n+1) * 6 + 5], PRIM_INT__d_s_p_s[n * 18 + 17]);
746 PRIM_INT__d_s_p_s[n * 18 + 17] = SIMINT_FMADD( vrr_const_2_over_2pq, PRIM_INT__p_s_s_s[(n+1) * 3 + 2], PRIM_INT__d_s_p_s[n * 18 + 17]);
747
748 }
749
750
751 VRR_K_f_s_d_s(
752 PRIM_INT__f_s_d_s,
753 PRIM_INT__f_s_p_s,
754 PRIM_INT__f_s_s_s,
755 PRIM_INT__d_s_p_s,
756 Q_PA,
757 a_over_q,
758 aoq_PQ,
759 one_over_2pq,
760 one_over_2q,
761 9);
762
763
764 ostei_general_vrr_K(4, 0, 3, 0, 8,
765 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
766 PRIM_INT__g_s_d_s, PRIM_INT__g_s_p_s, NULL, PRIM_INT__f_s_d_s, NULL, PRIM_INT__g_s_f_s);
767
768
769 ostei_general_vrr_K(5, 0, 4, 0, 7,
770 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
771 PRIM_INT__h_s_f_s, PRIM_INT__h_s_d_s, NULL, PRIM_INT__g_s_f_s, NULL, PRIM_INT__h_s_g_s);
772
773
774 ostei_general_vrr_K(6, 0, 5, 0, 6,
775 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
776 PRIM_INT__i_s_g_s, PRIM_INT__i_s_f_s, NULL, PRIM_INT__h_s_g_s, NULL, PRIM_INT__i_s_h_s);
777
778
779
780 // Forming PRIM_INT__p_s_p_s[10 * 9];
781 for(n = 0; n < 10; ++n) // loop over orders of auxiliary function
782 {
783
784 PRIM_INT__p_s_p_s[n * 9 + 0] = SIMINT_MUL(Q_PA[0], PRIM_INT__p_s_s_s[n * 3 + 0]);
785 PRIM_INT__p_s_p_s[n * 9 + 0] = SIMINT_FMADD( aoq_PQ[0], PRIM_INT__p_s_s_s[(n+1) * 3 + 0], PRIM_INT__p_s_p_s[n * 9 + 0]);
786 PRIM_INT__p_s_p_s[n * 9 + 0] = SIMINT_FMADD( vrr_const_1_over_2pq, PRIM_INT__s_s_s_s[(n+1) * 1 + 0], PRIM_INT__p_s_p_s[n * 9 + 0]);
787
788 PRIM_INT__p_s_p_s[n * 9 + 1] = SIMINT_MUL(Q_PA[1], PRIM_INT__p_s_s_s[n * 3 + 0]);
789 PRIM_INT__p_s_p_s[n * 9 + 1] = SIMINT_FMADD( aoq_PQ[1], PRIM_INT__p_s_s_s[(n+1) * 3 + 0], PRIM_INT__p_s_p_s[n * 9 + 1]);
790
791 PRIM_INT__p_s_p_s[n * 9 + 2] = SIMINT_MUL(Q_PA[2], PRIM_INT__p_s_s_s[n * 3 + 0]);
792 PRIM_INT__p_s_p_s[n * 9 + 2] = SIMINT_FMADD( aoq_PQ[2], PRIM_INT__p_s_s_s[(n+1) * 3 + 0], PRIM_INT__p_s_p_s[n * 9 + 2]);
793
794 PRIM_INT__p_s_p_s[n * 9 + 3] = SIMINT_MUL(Q_PA[0], PRIM_INT__p_s_s_s[n * 3 + 1]);
795 PRIM_INT__p_s_p_s[n * 9 + 3] = SIMINT_FMADD( aoq_PQ[0], PRIM_INT__p_s_s_s[(n+1) * 3 + 1], PRIM_INT__p_s_p_s[n * 9 + 3]);
796
797 PRIM_INT__p_s_p_s[n * 9 + 4] = SIMINT_MUL(Q_PA[1], PRIM_INT__p_s_s_s[n * 3 + 1]);
798 PRIM_INT__p_s_p_s[n * 9 + 4] = SIMINT_FMADD( aoq_PQ[1], PRIM_INT__p_s_s_s[(n+1) * 3 + 1], PRIM_INT__p_s_p_s[n * 9 + 4]);
799 PRIM_INT__p_s_p_s[n * 9 + 4] = SIMINT_FMADD( vrr_const_1_over_2pq, PRIM_INT__s_s_s_s[(n+1) * 1 + 0], PRIM_INT__p_s_p_s[n * 9 + 4]);
800
801 PRIM_INT__p_s_p_s[n * 9 + 5] = SIMINT_MUL(Q_PA[2], PRIM_INT__p_s_s_s[n * 3 + 1]);
802 PRIM_INT__p_s_p_s[n * 9 + 5] = SIMINT_FMADD( aoq_PQ[2], PRIM_INT__p_s_s_s[(n+1) * 3 + 1], PRIM_INT__p_s_p_s[n * 9 + 5]);
803
804 PRIM_INT__p_s_p_s[n * 9 + 6] = SIMINT_MUL(Q_PA[0], PRIM_INT__p_s_s_s[n * 3 + 2]);
805 PRIM_INT__p_s_p_s[n * 9 + 6] = SIMINT_FMADD( aoq_PQ[0], PRIM_INT__p_s_s_s[(n+1) * 3 + 2], PRIM_INT__p_s_p_s[n * 9 + 6]);
806
807 PRIM_INT__p_s_p_s[n * 9 + 7] = SIMINT_MUL(Q_PA[1], PRIM_INT__p_s_s_s[n * 3 + 2]);
808 PRIM_INT__p_s_p_s[n * 9 + 7] = SIMINT_FMADD( aoq_PQ[1], PRIM_INT__p_s_s_s[(n+1) * 3 + 2], PRIM_INT__p_s_p_s[n * 9 + 7]);
809
810 PRIM_INT__p_s_p_s[n * 9 + 8] = SIMINT_MUL(Q_PA[2], PRIM_INT__p_s_s_s[n * 3 + 2]);
811 PRIM_INT__p_s_p_s[n * 9 + 8] = SIMINT_FMADD( aoq_PQ[2], PRIM_INT__p_s_s_s[(n+1) * 3 + 2], PRIM_INT__p_s_p_s[n * 9 + 8]);
812 PRIM_INT__p_s_p_s[n * 9 + 8] = SIMINT_FMADD( vrr_const_1_over_2pq, PRIM_INT__s_s_s_s[(n+1) * 1 + 0], PRIM_INT__p_s_p_s[n * 9 + 8]);
813
814 }
815
816
817 VRR_K_d_s_d_s(
818 PRIM_INT__d_s_d_s,
819 PRIM_INT__d_s_p_s,
820 PRIM_INT__d_s_s_s,
821 PRIM_INT__p_s_p_s,
822 Q_PA,
823 a_over_q,
824 aoq_PQ,
825 one_over_2pq,
826 one_over_2q,
827 9);
828
829
830 ostei_general_vrr_K(3, 0, 3, 0, 8,
831 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
832 PRIM_INT__f_s_d_s, PRIM_INT__f_s_p_s, NULL, PRIM_INT__d_s_d_s, NULL, PRIM_INT__f_s_f_s);
833
834
835 ostei_general_vrr_K(4, 0, 4, 0, 7,
836 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
837 PRIM_INT__g_s_f_s, PRIM_INT__g_s_d_s, NULL, PRIM_INT__f_s_f_s, NULL, PRIM_INT__g_s_g_s);
838
839
840 ostei_general_vrr_K(5, 0, 5, 0, 6,
841 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
842 PRIM_INT__h_s_g_s, PRIM_INT__h_s_f_s, NULL, PRIM_INT__g_s_g_s, NULL, PRIM_INT__h_s_h_s);
843
844
845 ostei_general_vrr_K(6, 0, 6, 0, 5,
846 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
847 PRIM_INT__i_s_h_s, PRIM_INT__i_s_g_s, NULL, PRIM_INT__h_s_h_s, NULL, PRIM_INT__i_s_i_s);
848
849
850
851 // Forming PRIM_INT__s_s_p_s[10 * 3];
852 for(n = 0; n < 10; ++n) // loop over orders of auxiliary function
853 {
854
855 PRIM_INT__s_s_p_s[n * 3 + 0] = SIMINT_MUL(Q_PA[0], PRIM_INT__s_s_s_s[n * 1 + 0]);
856 PRIM_INT__s_s_p_s[n * 3 + 0] = SIMINT_FMADD( aoq_PQ[0], PRIM_INT__s_s_s_s[(n+1) * 1 + 0], PRIM_INT__s_s_p_s[n * 3 + 0]);
857
858 PRIM_INT__s_s_p_s[n * 3 + 1] = SIMINT_MUL(Q_PA[1], PRIM_INT__s_s_s_s[n * 1 + 0]);
859 PRIM_INT__s_s_p_s[n * 3 + 1] = SIMINT_FMADD( aoq_PQ[1], PRIM_INT__s_s_s_s[(n+1) * 1 + 0], PRIM_INT__s_s_p_s[n * 3 + 1]);
860
861 PRIM_INT__s_s_p_s[n * 3 + 2] = SIMINT_MUL(Q_PA[2], PRIM_INT__s_s_s_s[n * 1 + 0]);
862 PRIM_INT__s_s_p_s[n * 3 + 2] = SIMINT_FMADD( aoq_PQ[2], PRIM_INT__s_s_s_s[(n+1) * 1 + 0], PRIM_INT__s_s_p_s[n * 3 + 2]);
863
864 }
865
866
867
868 // Forming PRIM_INT__p_s_d_s[9 * 18];
869 for(n = 0; n < 9; ++n) // loop over orders of auxiliary function
870 {
871
872 PRIM_INT__p_s_d_s[n * 18 + 0] = SIMINT_MUL(Q_PA[0], PRIM_INT__p_s_p_s[n * 9 + 0]);
873 PRIM_INT__p_s_d_s[n * 18 + 0] = SIMINT_FMADD( aoq_PQ[0], PRIM_INT__p_s_p_s[(n+1) * 9 + 0], PRIM_INT__p_s_d_s[n * 18 + 0]);
874 PRIM_INT__p_s_d_s[n * 18 + 0] = SIMINT_FMADD( vrr_const_1_over_2q, SIMINT_FMADD(a_over_q, PRIM_INT__p_s_s_s[(n+1) * 3 + 0], PRIM_INT__p_s_s_s[n * 3 + 0]), PRIM_INT__p_s_d_s[n * 18 + 0]);
875 PRIM_INT__p_s_d_s[n * 18 + 0] = SIMINT_FMADD( vrr_const_1_over_2pq, PRIM_INT__s_s_p_s[(n+1) * 3 + 0], PRIM_INT__p_s_d_s[n * 18 + 0]);
876
877 PRIM_INT__p_s_d_s[n * 18 + 3] = SIMINT_MUL(Q_PA[1], PRIM_INT__p_s_p_s[n * 9 + 1]);
878 PRIM_INT__p_s_d_s[n * 18 + 3] = SIMINT_FMADD( aoq_PQ[1], PRIM_INT__p_s_p_s[(n+1) * 9 + 1], PRIM_INT__p_s_d_s[n * 18 + 3]);
879 PRIM_INT__p_s_d_s[n * 18 + 3] = SIMINT_FMADD( vrr_const_1_over_2q, SIMINT_FMADD(a_over_q, PRIM_INT__p_s_s_s[(n+1) * 3 + 0], PRIM_INT__p_s_s_s[n * 3 + 0]), PRIM_INT__p_s_d_s[n * 18 + 3]);
880
881 PRIM_INT__p_s_d_s[n * 18 + 5] = SIMINT_MUL(Q_PA[2], PRIM_INT__p_s_p_s[n * 9 + 2]);
882 PRIM_INT__p_s_d_s[n * 18 + 5] = SIMINT_FMADD( aoq_PQ[2], PRIM_INT__p_s_p_s[(n+1) * 9 + 2], PRIM_INT__p_s_d_s[n * 18 + 5]);
883 PRIM_INT__p_s_d_s[n * 18 + 5] = SIMINT_FMADD( vrr_const_1_over_2q, SIMINT_FMADD(a_over_q, PRIM_INT__p_s_s_s[(n+1) * 3 + 0], PRIM_INT__p_s_s_s[n * 3 + 0]), PRIM_INT__p_s_d_s[n * 18 + 5]);
884
885 PRIM_INT__p_s_d_s[n * 18 + 6] = SIMINT_MUL(Q_PA[0], PRIM_INT__p_s_p_s[n * 9 + 3]);
886 PRIM_INT__p_s_d_s[n * 18 + 6] = SIMINT_FMADD( aoq_PQ[0], PRIM_INT__p_s_p_s[(n+1) * 9 + 3], PRIM_INT__p_s_d_s[n * 18 + 6]);
887 PRIM_INT__p_s_d_s[n * 18 + 6] = SIMINT_FMADD( vrr_const_1_over_2q, SIMINT_FMADD(a_over_q, PRIM_INT__p_s_s_s[(n+1) * 3 + 1], PRIM_INT__p_s_s_s[n * 3 + 1]), PRIM_INT__p_s_d_s[n * 18 + 6]);
888
889 PRIM_INT__p_s_d_s[n * 18 + 9] = SIMINT_MUL(Q_PA[1], PRIM_INT__p_s_p_s[n * 9 + 4]);
890 PRIM_INT__p_s_d_s[n * 18 + 9] = SIMINT_FMADD( aoq_PQ[1], PRIM_INT__p_s_p_s[(n+1) * 9 + 4], PRIM_INT__p_s_d_s[n * 18 + 9]);
891 PRIM_INT__p_s_d_s[n * 18 + 9] = SIMINT_FMADD( vrr_const_1_over_2q, SIMINT_FMADD(a_over_q, PRIM_INT__p_s_s_s[(n+1) * 3 + 1], PRIM_INT__p_s_s_s[n * 3 + 1]), PRIM_INT__p_s_d_s[n * 18 + 9]);
892 PRIM_INT__p_s_d_s[n * 18 + 9] = SIMINT_FMADD( vrr_const_1_over_2pq, PRIM_INT__s_s_p_s[(n+1) * 3 + 1], PRIM_INT__p_s_d_s[n * 18 + 9]);
893
894 PRIM_INT__p_s_d_s[n * 18 + 11] = SIMINT_MUL(Q_PA[2], PRIM_INT__p_s_p_s[n * 9 + 5]);
895 PRIM_INT__p_s_d_s[n * 18 + 11] = SIMINT_FMADD( aoq_PQ[2], PRIM_INT__p_s_p_s[(n+1) * 9 + 5], PRIM_INT__p_s_d_s[n * 18 + 11]);
896 PRIM_INT__p_s_d_s[n * 18 + 11] = SIMINT_FMADD( vrr_const_1_over_2q, SIMINT_FMADD(a_over_q, PRIM_INT__p_s_s_s[(n+1) * 3 + 1], PRIM_INT__p_s_s_s[n * 3 + 1]), PRIM_INT__p_s_d_s[n * 18 + 11]);
897
898 PRIM_INT__p_s_d_s[n * 18 + 12] = SIMINT_MUL(Q_PA[0], PRIM_INT__p_s_p_s[n * 9 + 6]);
899 PRIM_INT__p_s_d_s[n * 18 + 12] = SIMINT_FMADD( aoq_PQ[0], PRIM_INT__p_s_p_s[(n+1) * 9 + 6], PRIM_INT__p_s_d_s[n * 18 + 12]);
900 PRIM_INT__p_s_d_s[n * 18 + 12] = SIMINT_FMADD( vrr_const_1_over_2q, SIMINT_FMADD(a_over_q, PRIM_INT__p_s_s_s[(n+1) * 3 + 2], PRIM_INT__p_s_s_s[n * 3 + 2]), PRIM_INT__p_s_d_s[n * 18 + 12]);
901
902 PRIM_INT__p_s_d_s[n * 18 + 15] = SIMINT_MUL(Q_PA[1], PRIM_INT__p_s_p_s[n * 9 + 7]);
903 PRIM_INT__p_s_d_s[n * 18 + 15] = SIMINT_FMADD( aoq_PQ[1], PRIM_INT__p_s_p_s[(n+1) * 9 + 7], PRIM_INT__p_s_d_s[n * 18 + 15]);
904 PRIM_INT__p_s_d_s[n * 18 + 15] = SIMINT_FMADD( vrr_const_1_over_2q, SIMINT_FMADD(a_over_q, PRIM_INT__p_s_s_s[(n+1) * 3 + 2], PRIM_INT__p_s_s_s[n * 3 + 2]), PRIM_INT__p_s_d_s[n * 18 + 15]);
905
906 PRIM_INT__p_s_d_s[n * 18 + 17] = SIMINT_MUL(Q_PA[2], PRIM_INT__p_s_p_s[n * 9 + 8]);
907 PRIM_INT__p_s_d_s[n * 18 + 17] = SIMINT_FMADD( aoq_PQ[2], PRIM_INT__p_s_p_s[(n+1) * 9 + 8], PRIM_INT__p_s_d_s[n * 18 + 17]);
908 PRIM_INT__p_s_d_s[n * 18 + 17] = SIMINT_FMADD( vrr_const_1_over_2q, SIMINT_FMADD(a_over_q, PRIM_INT__p_s_s_s[(n+1) * 3 + 2], PRIM_INT__p_s_s_s[n * 3 + 2]), PRIM_INT__p_s_d_s[n * 18 + 17]);
909 PRIM_INT__p_s_d_s[n * 18 + 17] = SIMINT_FMADD( vrr_const_1_over_2pq, PRIM_INT__s_s_p_s[(n+1) * 3 + 2], PRIM_INT__p_s_d_s[n * 18 + 17]);
910
911 }
912
913
914 VRR_K_d_s_f_s(
915 PRIM_INT__d_s_f_s,
916 PRIM_INT__d_s_d_s,
917 PRIM_INT__d_s_p_s,
918 PRIM_INT__p_s_d_s,
919 Q_PA,
920 a_over_q,
921 aoq_PQ,
922 one_over_2pq,
923 one_over_2q,
924 8);
925
926
927 ostei_general_vrr_K(3, 0, 4, 0, 7,
928 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
929 PRIM_INT__f_s_f_s, PRIM_INT__f_s_d_s, NULL, PRIM_INT__d_s_f_s, NULL, PRIM_INT__f_s_g_s);
930
931
932 ostei_general_vrr_K(4, 0, 5, 0, 6,
933 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
934 PRIM_INT__g_s_g_s, PRIM_INT__g_s_f_s, NULL, PRIM_INT__f_s_g_s, NULL, PRIM_INT__g_s_h_s);
935
936
937 ostei_general_vrr_K(5, 0, 6, 0, 5,
938 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
939 PRIM_INT__h_s_h_s, PRIM_INT__h_s_g_s, NULL, PRIM_INT__g_s_h_s, NULL, PRIM_INT__h_s_i_s);
940
941
942 ostei_general_vrr_K(6, 0, 7, 0, 4,
943 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
944 PRIM_INT__i_s_i_s, PRIM_INT__i_s_h_s, NULL, PRIM_INT__h_s_i_s, NULL, PRIM_INT__i_s_k_s);
945
946
947
948 // Forming PRIM_INT__s_s_d_s[9 * 6];
949 for(n = 0; n < 9; ++n) // loop over orders of auxiliary function
950 {
951
952 PRIM_INT__s_s_d_s[n * 6 + 0] = SIMINT_MUL(Q_PA[0], PRIM_INT__s_s_p_s[n * 3 + 0]);
953 PRIM_INT__s_s_d_s[n * 6 + 0] = SIMINT_FMADD( aoq_PQ[0], PRIM_INT__s_s_p_s[(n+1) * 3 + 0], PRIM_INT__s_s_d_s[n * 6 + 0]);
954 PRIM_INT__s_s_d_s[n * 6 + 0] = SIMINT_FMADD( vrr_const_1_over_2q, SIMINT_FMADD(a_over_q, PRIM_INT__s_s_s_s[(n+1) * 1 + 0], PRIM_INT__s_s_s_s[n * 1 + 0]), PRIM_INT__s_s_d_s[n * 6 + 0]);
955
956 PRIM_INT__s_s_d_s[n * 6 + 3] = SIMINT_MUL(Q_PA[1], PRIM_INT__s_s_p_s[n * 3 + 1]);
957 PRIM_INT__s_s_d_s[n * 6 + 3] = SIMINT_FMADD( aoq_PQ[1], PRIM_INT__s_s_p_s[(n+1) * 3 + 1], PRIM_INT__s_s_d_s[n * 6 + 3]);
958 PRIM_INT__s_s_d_s[n * 6 + 3] = SIMINT_FMADD( vrr_const_1_over_2q, SIMINT_FMADD(a_over_q, PRIM_INT__s_s_s_s[(n+1) * 1 + 0], PRIM_INT__s_s_s_s[n * 1 + 0]), PRIM_INT__s_s_d_s[n * 6 + 3]);
959
960 PRIM_INT__s_s_d_s[n * 6 + 5] = SIMINT_MUL(Q_PA[2], PRIM_INT__s_s_p_s[n * 3 + 2]);
961 PRIM_INT__s_s_d_s[n * 6 + 5] = SIMINT_FMADD( aoq_PQ[2], PRIM_INT__s_s_p_s[(n+1) * 3 + 2], PRIM_INT__s_s_d_s[n * 6 + 5]);
962 PRIM_INT__s_s_d_s[n * 6 + 5] = SIMINT_FMADD( vrr_const_1_over_2q, SIMINT_FMADD(a_over_q, PRIM_INT__s_s_s_s[(n+1) * 1 + 0], PRIM_INT__s_s_s_s[n * 1 + 0]), PRIM_INT__s_s_d_s[n * 6 + 5]);
963
964 }
965
966
967 VRR_K_p_s_f_s(
968 PRIM_INT__p_s_f_s,
969 PRIM_INT__p_s_d_s,
970 PRIM_INT__p_s_p_s,
971 PRIM_INT__s_s_d_s,
972 Q_PA,
973 a_over_q,
974 aoq_PQ,
975 one_over_2pq,
976 one_over_2q,
977 8);
978
979
980 ostei_general_vrr_K(2, 0, 4, 0, 7,
981 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
982 PRIM_INT__d_s_f_s, PRIM_INT__d_s_d_s, NULL, PRIM_INT__p_s_f_s, NULL, PRIM_INT__d_s_g_s);
983
984
985 ostei_general_vrr_K(3, 0, 5, 0, 6,
986 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
987 PRIM_INT__f_s_g_s, PRIM_INT__f_s_f_s, NULL, PRIM_INT__d_s_g_s, NULL, PRIM_INT__f_s_h_s);
988
989
990 ostei_general_vrr_K(4, 0, 6, 0, 5,
991 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
992 PRIM_INT__g_s_h_s, PRIM_INT__g_s_g_s, NULL, PRIM_INT__f_s_h_s, NULL, PRIM_INT__g_s_i_s);
993
994
995 ostei_general_vrr_K(5, 0, 7, 0, 4,
996 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
997 PRIM_INT__h_s_i_s, PRIM_INT__h_s_h_s, NULL, PRIM_INT__g_s_i_s, NULL, PRIM_INT__h_s_k_s);
998
999
1000 ostei_general_vrr_K(6, 0, 8, 0, 3,
1001 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1002 PRIM_INT__i_s_k_s, PRIM_INT__i_s_i_s, NULL, PRIM_INT__h_s_k_s, NULL, PRIM_INT__i_s_l_s);
1003
1004
1005 ostei_general_vrr1_I(7, 15,
1006 one_over_2p, a_over_p, aop_PQ, P_PA,
1007 PRIM_INT__i_s_s_s, PRIM_INT__h_s_s_s, PRIM_INT__k_s_s_s);
1008
1009
1010 ostei_general_vrr_K(7, 0, 1, 0, 10,
1011 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1012 PRIM_INT__k_s_s_s, NULL, NULL, PRIM_INT__i_s_s_s, NULL, PRIM_INT__k_s_p_s);
1013
1014
1015 ostei_general_vrr_K(7, 0, 2, 0, 9,
1016 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1017 PRIM_INT__k_s_p_s, PRIM_INT__k_s_s_s, NULL, PRIM_INT__i_s_p_s, NULL, PRIM_INT__k_s_d_s);
1018
1019
1020 ostei_general_vrr_K(7, 0, 3, 0, 8,
1021 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1022 PRIM_INT__k_s_d_s, PRIM_INT__k_s_p_s, NULL, PRIM_INT__i_s_d_s, NULL, PRIM_INT__k_s_f_s);
1023
1024
1025 ostei_general_vrr_K(7, 0, 4, 0, 7,
1026 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1027 PRIM_INT__k_s_f_s, PRIM_INT__k_s_d_s, NULL, PRIM_INT__i_s_f_s, NULL, PRIM_INT__k_s_g_s);
1028
1029
1030 ostei_general_vrr_K(7, 0, 5, 0, 6,
1031 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1032 PRIM_INT__k_s_g_s, PRIM_INT__k_s_f_s, NULL, PRIM_INT__i_s_g_s, NULL, PRIM_INT__k_s_h_s);
1033
1034
1035 ostei_general_vrr_K(7, 0, 6, 0, 5,
1036 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1037 PRIM_INT__k_s_h_s, PRIM_INT__k_s_g_s, NULL, PRIM_INT__i_s_h_s, NULL, PRIM_INT__k_s_i_s);
1038
1039
1040 ostei_general_vrr_K(7, 0, 7, 0, 4,
1041 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1042 PRIM_INT__k_s_i_s, PRIM_INT__k_s_h_s, NULL, PRIM_INT__i_s_i_s, NULL, PRIM_INT__k_s_k_s);
1043
1044
1045
1046 // Forming PRIM_INT__s_s_f_s[8 * 10];
1047 for(n = 0; n < 8; ++n) // loop over orders of auxiliary function
1048 {
1049
1050 PRIM_INT__s_s_f_s[n * 10 + 0] = SIMINT_MUL(Q_PA[0], PRIM_INT__s_s_d_s[n * 6 + 0]);
1051 PRIM_INT__s_s_f_s[n * 10 + 0] = SIMINT_FMADD( aoq_PQ[0], PRIM_INT__s_s_d_s[(n+1) * 6 + 0], PRIM_INT__s_s_f_s[n * 10 + 0]);
1052 PRIM_INT__s_s_f_s[n * 10 + 0] = SIMINT_FMADD( vrr_const_2_over_2q, SIMINT_FMADD(a_over_q, PRIM_INT__s_s_p_s[(n+1) * 3 + 0], PRIM_INT__s_s_p_s[n * 3 + 0]), PRIM_INT__s_s_f_s[n * 10 + 0]);
1053
1054 PRIM_INT__s_s_f_s[n * 10 + 6] = SIMINT_MUL(Q_PA[1], PRIM_INT__s_s_d_s[n * 6 + 3]);
1055 PRIM_INT__s_s_f_s[n * 10 + 6] = SIMINT_FMADD( aoq_PQ[1], PRIM_INT__s_s_d_s[(n+1) * 6 + 3], PRIM_INT__s_s_f_s[n * 10 + 6]);
1056 PRIM_INT__s_s_f_s[n * 10 + 6] = SIMINT_FMADD( vrr_const_2_over_2q, SIMINT_FMADD(a_over_q, PRIM_INT__s_s_p_s[(n+1) * 3 + 1], PRIM_INT__s_s_p_s[n * 3 + 1]), PRIM_INT__s_s_f_s[n * 10 + 6]);
1057
1058 PRIM_INT__s_s_f_s[n * 10 + 9] = SIMINT_MUL(Q_PA[2], PRIM_INT__s_s_d_s[n * 6 + 5]);
1059 PRIM_INT__s_s_f_s[n * 10 + 9] = SIMINT_FMADD( aoq_PQ[2], PRIM_INT__s_s_d_s[(n+1) * 6 + 5], PRIM_INT__s_s_f_s[n * 10 + 9]);
1060 PRIM_INT__s_s_f_s[n * 10 + 9] = SIMINT_FMADD( vrr_const_2_over_2q, SIMINT_FMADD(a_over_q, PRIM_INT__s_s_p_s[(n+1) * 3 + 2], PRIM_INT__s_s_p_s[n * 3 + 2]), PRIM_INT__s_s_f_s[n * 10 + 9]);
1061
1062 }
1063
1064
1065 VRR_K_p_s_g_s(
1066 PRIM_INT__p_s_g_s,
1067 PRIM_INT__p_s_f_s,
1068 PRIM_INT__p_s_d_s,
1069 PRIM_INT__s_s_f_s,
1070 Q_PA,
1071 a_over_q,
1072 aoq_PQ,
1073 one_over_2pq,
1074 one_over_2q,
1075 7);
1076
1077
1078 ostei_general_vrr_K(2, 0, 5, 0, 6,
1079 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1080 PRIM_INT__d_s_g_s, PRIM_INT__d_s_f_s, NULL, PRIM_INT__p_s_g_s, NULL, PRIM_INT__d_s_h_s);
1081
1082
1083 ostei_general_vrr_K(3, 0, 6, 0, 5,
1084 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1085 PRIM_INT__f_s_h_s, PRIM_INT__f_s_g_s, NULL, PRIM_INT__d_s_h_s, NULL, PRIM_INT__f_s_i_s);
1086
1087
1088 ostei_general_vrr_K(4, 0, 7, 0, 4,
1089 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1090 PRIM_INT__g_s_i_s, PRIM_INT__g_s_h_s, NULL, PRIM_INT__f_s_i_s, NULL, PRIM_INT__g_s_k_s);
1091
1092
1093 ostei_general_vrr_K(5, 0, 8, 0, 3,
1094 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1095 PRIM_INT__h_s_k_s, PRIM_INT__h_s_i_s, NULL, PRIM_INT__g_s_k_s, NULL, PRIM_INT__h_s_l_s);
1096
1097
1098 ostei_general_vrr_K(6, 0, 9, 0, 2,
1099 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1100 PRIM_INT__i_s_l_s, PRIM_INT__i_s_k_s, NULL, PRIM_INT__h_s_l_s, NULL, PRIM_INT__i_s_m_s);
1101
1102
1103 ostei_general_vrr_K(7, 0, 8, 0, 3,
1104 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1105 PRIM_INT__k_s_k_s, PRIM_INT__k_s_i_s, NULL, PRIM_INT__i_s_k_s, NULL, PRIM_INT__k_s_l_s);
1106
1107
1108 ostei_general_vrr1_I(8, 14,
1109 one_over_2p, a_over_p, aop_PQ, P_PA,
1110 PRIM_INT__k_s_s_s, PRIM_INT__i_s_s_s, PRIM_INT__l_s_s_s);
1111
1112
1113 ostei_general_vrr_K(8, 0, 1, 0, 10,
1114 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1115 PRIM_INT__l_s_s_s, NULL, NULL, PRIM_INT__k_s_s_s, NULL, PRIM_INT__l_s_p_s);
1116
1117
1118 ostei_general_vrr_K(8, 0, 2, 0, 9,
1119 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1120 PRIM_INT__l_s_p_s, PRIM_INT__l_s_s_s, NULL, PRIM_INT__k_s_p_s, NULL, PRIM_INT__l_s_d_s);
1121
1122
1123 ostei_general_vrr_K(8, 0, 3, 0, 8,
1124 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1125 PRIM_INT__l_s_d_s, PRIM_INT__l_s_p_s, NULL, PRIM_INT__k_s_d_s, NULL, PRIM_INT__l_s_f_s);
1126
1127
1128 ostei_general_vrr_K(8, 0, 4, 0, 7,
1129 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1130 PRIM_INT__l_s_f_s, PRIM_INT__l_s_d_s, NULL, PRIM_INT__k_s_f_s, NULL, PRIM_INT__l_s_g_s);
1131
1132
1133 ostei_general_vrr_K(8, 0, 5, 0, 6,
1134 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1135 PRIM_INT__l_s_g_s, PRIM_INT__l_s_f_s, NULL, PRIM_INT__k_s_g_s, NULL, PRIM_INT__l_s_h_s);
1136
1137
1138 ostei_general_vrr_K(8, 0, 6, 0, 5,
1139 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1140 PRIM_INT__l_s_h_s, PRIM_INT__l_s_g_s, NULL, PRIM_INT__k_s_h_s, NULL, PRIM_INT__l_s_i_s);
1141
1142
1143 ostei_general_vrr_K(8, 0, 7, 0, 4,
1144 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1145 PRIM_INT__l_s_i_s, PRIM_INT__l_s_h_s, NULL, PRIM_INT__k_s_i_s, NULL, PRIM_INT__l_s_k_s);
1146
1147
1148 VRR_K_s_s_g_s(
1149 PRIM_INT__s_s_g_s,
1150 PRIM_INT__s_s_f_s,
1151 PRIM_INT__s_s_d_s,
1152 Q_PA,
1153 a_over_q,
1154 aoq_PQ,
1155 one_over_2q,
1156 7);
1157
1158
1159 ostei_general_vrr_K(1, 0, 5, 0, 6,
1160 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1161 PRIM_INT__p_s_g_s, PRIM_INT__p_s_f_s, NULL, PRIM_INT__s_s_g_s, NULL, PRIM_INT__p_s_h_s);
1162
1163
1164 ostei_general_vrr_K(2, 0, 6, 0, 5,
1165 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1166 PRIM_INT__d_s_h_s, PRIM_INT__d_s_g_s, NULL, PRIM_INT__p_s_h_s, NULL, PRIM_INT__d_s_i_s);
1167
1168
1169 ostei_general_vrr_K(3, 0, 7, 0, 4,
1170 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1171 PRIM_INT__f_s_i_s, PRIM_INT__f_s_h_s, NULL, PRIM_INT__d_s_i_s, NULL, PRIM_INT__f_s_k_s);
1172
1173
1174 ostei_general_vrr_K(4, 0, 8, 0, 3,
1175 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1176 PRIM_INT__g_s_k_s, PRIM_INT__g_s_i_s, NULL, PRIM_INT__f_s_k_s, NULL, PRIM_INT__g_s_l_s);
1177
1178
1179 ostei_general_vrr_K(5, 0, 9, 0, 2,
1180 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1181 PRIM_INT__h_s_l_s, PRIM_INT__h_s_k_s, NULL, PRIM_INT__g_s_l_s, NULL, PRIM_INT__h_s_m_s);
1182
1183
1184 ostei_general_vrr_K(6, 0, 10, 0, 1,
1185 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1186 PRIM_INT__i_s_m_s, PRIM_INT__i_s_l_s, NULL, PRIM_INT__h_s_m_s, NULL, PRIM_INT__i_s_n_s);
1187
1188
1189 ostei_general_vrr_K(7, 0, 9, 0, 2,
1190 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1191 PRIM_INT__k_s_l_s, PRIM_INT__k_s_k_s, NULL, PRIM_INT__i_s_l_s, NULL, PRIM_INT__k_s_m_s);
1192
1193
1194 ostei_general_vrr_K(8, 0, 8, 0, 3,
1195 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1196 PRIM_INT__l_s_k_s, PRIM_INT__l_s_i_s, NULL, PRIM_INT__k_s_k_s, NULL, PRIM_INT__l_s_l_s);
1197
1198
1199 ostei_general_vrr1_I(9, 13,
1200 one_over_2p, a_over_p, aop_PQ, P_PA,
1201 PRIM_INT__l_s_s_s, PRIM_INT__k_s_s_s, PRIM_INT__m_s_s_s);
1202
1203
1204 ostei_general_vrr_K(9, 0, 1, 0, 10,
1205 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1206 PRIM_INT__m_s_s_s, NULL, NULL, PRIM_INT__l_s_s_s, NULL, PRIM_INT__m_s_p_s);
1207
1208
1209 ostei_general_vrr_K(9, 0, 2, 0, 9,
1210 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1211 PRIM_INT__m_s_p_s, PRIM_INT__m_s_s_s, NULL, PRIM_INT__l_s_p_s, NULL, PRIM_INT__m_s_d_s);
1212
1213
1214 ostei_general_vrr_K(9, 0, 3, 0, 8,
1215 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1216 PRIM_INT__m_s_d_s, PRIM_INT__m_s_p_s, NULL, PRIM_INT__l_s_d_s, NULL, PRIM_INT__m_s_f_s);
1217
1218
1219 ostei_general_vrr_K(9, 0, 4, 0, 7,
1220 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1221 PRIM_INT__m_s_f_s, PRIM_INT__m_s_d_s, NULL, PRIM_INT__l_s_f_s, NULL, PRIM_INT__m_s_g_s);
1222
1223
1224 ostei_general_vrr_K(9, 0, 5, 0, 6,
1225 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1226 PRIM_INT__m_s_g_s, PRIM_INT__m_s_f_s, NULL, PRIM_INT__l_s_g_s, NULL, PRIM_INT__m_s_h_s);
1227
1228
1229 ostei_general_vrr_K(9, 0, 6, 0, 5,
1230 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1231 PRIM_INT__m_s_h_s, PRIM_INT__m_s_g_s, NULL, PRIM_INT__l_s_h_s, NULL, PRIM_INT__m_s_i_s);
1232
1233
1234 ostei_general_vrr_K(9, 0, 7, 0, 4,
1235 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1236 PRIM_INT__m_s_i_s, PRIM_INT__m_s_h_s, NULL, PRIM_INT__l_s_i_s, NULL, PRIM_INT__m_s_k_s);
1237
1238
1239 ostei_general_vrr_K(7, 0, 10, 0, 1,
1240 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1241 PRIM_INT__k_s_m_s, PRIM_INT__k_s_l_s, NULL, PRIM_INT__i_s_m_s, NULL, PRIM_INT__k_s_n_s);
1242
1243
1244 ostei_general_vrr_K(8, 0, 9, 0, 2,
1245 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1246 PRIM_INT__l_s_l_s, PRIM_INT__l_s_k_s, NULL, PRIM_INT__k_s_l_s, NULL, PRIM_INT__l_s_m_s);
1247
1248
1249 ostei_general_vrr_K(9, 0, 8, 0, 3,
1250 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1251 PRIM_INT__m_s_k_s, PRIM_INT__m_s_i_s, NULL, PRIM_INT__l_s_k_s, NULL, PRIM_INT__m_s_l_s);
1252
1253
1254 ostei_general_vrr1_I(10, 12,
1255 one_over_2p, a_over_p, aop_PQ, P_PA,
1256 PRIM_INT__m_s_s_s, PRIM_INT__l_s_s_s, PRIM_INT__n_s_s_s);
1257
1258
1259 ostei_general_vrr_K(10, 0, 1, 0, 10,
1260 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1261 PRIM_INT__n_s_s_s, NULL, NULL, PRIM_INT__m_s_s_s, NULL, PRIM_INT__n_s_p_s);
1262
1263
1264 ostei_general_vrr_K(10, 0, 2, 0, 9,
1265 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1266 PRIM_INT__n_s_p_s, PRIM_INT__n_s_s_s, NULL, PRIM_INT__m_s_p_s, NULL, PRIM_INT__n_s_d_s);
1267
1268
1269 ostei_general_vrr_K(10, 0, 3, 0, 8,
1270 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1271 PRIM_INT__n_s_d_s, PRIM_INT__n_s_p_s, NULL, PRIM_INT__m_s_d_s, NULL, PRIM_INT__n_s_f_s);
1272
1273
1274 ostei_general_vrr_K(10, 0, 4, 0, 7,
1275 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1276 PRIM_INT__n_s_f_s, PRIM_INT__n_s_d_s, NULL, PRIM_INT__m_s_f_s, NULL, PRIM_INT__n_s_g_s);
1277
1278
1279 ostei_general_vrr_K(10, 0, 5, 0, 6,
1280 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1281 PRIM_INT__n_s_g_s, PRIM_INT__n_s_f_s, NULL, PRIM_INT__m_s_g_s, NULL, PRIM_INT__n_s_h_s);
1282
1283
1284 ostei_general_vrr_K(10, 0, 6, 0, 5,
1285 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1286 PRIM_INT__n_s_h_s, PRIM_INT__n_s_g_s, NULL, PRIM_INT__m_s_h_s, NULL, PRIM_INT__n_s_i_s);
1287
1288
1289 ostei_general_vrr_K(10, 0, 7, 0, 4,
1290 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1291 PRIM_INT__n_s_i_s, PRIM_INT__n_s_h_s, NULL, PRIM_INT__m_s_i_s, NULL, PRIM_INT__n_s_k_s);
1292
1293
1294 ostei_general_vrr_K(8, 0, 10, 0, 1,
1295 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1296 PRIM_INT__l_s_m_s, PRIM_INT__l_s_l_s, NULL, PRIM_INT__k_s_m_s, NULL, PRIM_INT__l_s_n_s);
1297
1298
1299 ostei_general_vrr_K(9, 0, 9, 0, 2,
1300 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1301 PRIM_INT__m_s_l_s, PRIM_INT__m_s_k_s, NULL, PRIM_INT__l_s_l_s, NULL, PRIM_INT__m_s_m_s);
1302
1303
1304 ostei_general_vrr_K(10, 0, 8, 0, 3,
1305 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1306 PRIM_INT__n_s_k_s, PRIM_INT__n_s_i_s, NULL, PRIM_INT__m_s_k_s, NULL, PRIM_INT__n_s_l_s);
1307
1308
1309 ostei_general_vrr1_I(11, 11,
1310 one_over_2p, a_over_p, aop_PQ, P_PA,
1311 PRIM_INT__n_s_s_s, PRIM_INT__m_s_s_s, PRIM_INT__o_s_s_s);
1312
1313
1314 ostei_general_vrr_K(11, 0, 1, 0, 10,
1315 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1316 PRIM_INT__o_s_s_s, NULL, NULL, PRIM_INT__n_s_s_s, NULL, PRIM_INT__o_s_p_s);
1317
1318
1319 ostei_general_vrr_K(11, 0, 2, 0, 9,
1320 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1321 PRIM_INT__o_s_p_s, PRIM_INT__o_s_s_s, NULL, PRIM_INT__n_s_p_s, NULL, PRIM_INT__o_s_d_s);
1322
1323
1324 ostei_general_vrr_K(11, 0, 3, 0, 8,
1325 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1326 PRIM_INT__o_s_d_s, PRIM_INT__o_s_p_s, NULL, PRIM_INT__n_s_d_s, NULL, PRIM_INT__o_s_f_s);
1327
1328
1329 ostei_general_vrr_K(11, 0, 4, 0, 7,
1330 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1331 PRIM_INT__o_s_f_s, PRIM_INT__o_s_d_s, NULL, PRIM_INT__n_s_f_s, NULL, PRIM_INT__o_s_g_s);
1332
1333
1334 ostei_general_vrr_K(11, 0, 5, 0, 6,
1335 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1336 PRIM_INT__o_s_g_s, PRIM_INT__o_s_f_s, NULL, PRIM_INT__n_s_g_s, NULL, PRIM_INT__o_s_h_s);
1337
1338
1339 ostei_general_vrr_K(11, 0, 6, 0, 5,
1340 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1341 PRIM_INT__o_s_h_s, PRIM_INT__o_s_g_s, NULL, PRIM_INT__n_s_h_s, NULL, PRIM_INT__o_s_i_s);
1342
1343
1344 ostei_general_vrr_K(11, 0, 7, 0, 4,
1345 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1346 PRIM_INT__o_s_i_s, PRIM_INT__o_s_h_s, NULL, PRIM_INT__n_s_i_s, NULL, PRIM_INT__o_s_k_s);
1347
1348
1349 ostei_general_vrr_K(9, 0, 10, 0, 1,
1350 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1351 PRIM_INT__m_s_m_s, PRIM_INT__m_s_l_s, NULL, PRIM_INT__l_s_m_s, NULL, PRIM_INT__m_s_n_s);
1352
1353
1354 ostei_general_vrr_K(10, 0, 9, 0, 2,
1355 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1356 PRIM_INT__n_s_l_s, PRIM_INT__n_s_k_s, NULL, PRIM_INT__m_s_l_s, NULL, PRIM_INT__n_s_m_s);
1357
1358
1359 ostei_general_vrr_K(11, 0, 8, 0, 3,
1360 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1361 PRIM_INT__o_s_k_s, PRIM_INT__o_s_i_s, NULL, PRIM_INT__n_s_k_s, NULL, PRIM_INT__o_s_l_s);
1362
1363
1364 ostei_general_vrr_K(10, 0, 10, 0, 1,
1365 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1366 PRIM_INT__n_s_m_s, PRIM_INT__n_s_l_s, NULL, PRIM_INT__m_s_m_s, NULL, PRIM_INT__n_s_n_s);
1367
1368
1369 ostei_general_vrr_K(11, 0, 9, 0, 2,
1370 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1371 PRIM_INT__o_s_l_s, PRIM_INT__o_s_k_s, NULL, PRIM_INT__n_s_l_s, NULL, PRIM_INT__o_s_m_s);
1372
1373
1374 ostei_general_vrr_K(11, 0, 10, 0, 1,
1375 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1376 PRIM_INT__o_s_m_s, PRIM_INT__o_s_l_s, NULL, PRIM_INT__n_s_m_s, NULL, PRIM_INT__o_s_n_s);
1377
1378
1379
1380
1381 ////////////////////////////////////
1382 // Accumulate contracted integrals
1383 ////////////////////////////////////
1384 if(lastoffset == 0)
1385 {
1386 contract_all(1008, PRIM_INT__i_s_k_s, PRIM_PTR_INT__i_s_k_s);
1387 contract_all(1260, PRIM_INT__i_s_l_s, PRIM_PTR_INT__i_s_l_s);
1388 contract_all(1540, PRIM_INT__i_s_m_s, PRIM_PTR_INT__i_s_m_s);
1389 contract_all(1848, PRIM_INT__i_s_n_s, PRIM_PTR_INT__i_s_n_s);
1390 contract_all(1296, PRIM_INT__k_s_k_s, PRIM_PTR_INT__k_s_k_s);
1391 contract_all(1620, PRIM_INT__k_s_l_s, PRIM_PTR_INT__k_s_l_s);
1392 contract_all(1980, PRIM_INT__k_s_m_s, PRIM_PTR_INT__k_s_m_s);
1393 contract_all(2376, PRIM_INT__k_s_n_s, PRIM_PTR_INT__k_s_n_s);
1394 contract_all(1620, PRIM_INT__l_s_k_s, PRIM_PTR_INT__l_s_k_s);
1395 contract_all(2025, PRIM_INT__l_s_l_s, PRIM_PTR_INT__l_s_l_s);
1396 contract_all(2475, PRIM_INT__l_s_m_s, PRIM_PTR_INT__l_s_m_s);
1397 contract_all(2970, PRIM_INT__l_s_n_s, PRIM_PTR_INT__l_s_n_s);
1398 contract_all(1980, PRIM_INT__m_s_k_s, PRIM_PTR_INT__m_s_k_s);
1399 contract_all(2475, PRIM_INT__m_s_l_s, PRIM_PTR_INT__m_s_l_s);
1400 contract_all(3025, PRIM_INT__m_s_m_s, PRIM_PTR_INT__m_s_m_s);
1401 contract_all(3630, PRIM_INT__m_s_n_s, PRIM_PTR_INT__m_s_n_s);
1402 contract_all(2376, PRIM_INT__n_s_k_s, PRIM_PTR_INT__n_s_k_s);
1403 contract_all(2970, PRIM_INT__n_s_l_s, PRIM_PTR_INT__n_s_l_s);
1404 contract_all(3630, PRIM_INT__n_s_m_s, PRIM_PTR_INT__n_s_m_s);
1405 contract_all(4356, PRIM_INT__n_s_n_s, PRIM_PTR_INT__n_s_n_s);
1406 contract_all(2808, PRIM_INT__o_s_k_s, PRIM_PTR_INT__o_s_k_s);
1407 contract_all(3510, PRIM_INT__o_s_l_s, PRIM_PTR_INT__o_s_l_s);
1408 contract_all(4290, PRIM_INT__o_s_m_s, PRIM_PTR_INT__o_s_m_s);
1409 contract_all(5148, PRIM_INT__o_s_n_s, PRIM_PTR_INT__o_s_n_s);
1410 }
1411 else
1412 {
1413 contract(1008, shelloffsets, PRIM_INT__i_s_k_s, PRIM_PTR_INT__i_s_k_s);
1414 contract(1260, shelloffsets, PRIM_INT__i_s_l_s, PRIM_PTR_INT__i_s_l_s);
1415 contract(1540, shelloffsets, PRIM_INT__i_s_m_s, PRIM_PTR_INT__i_s_m_s);
1416 contract(1848, shelloffsets, PRIM_INT__i_s_n_s, PRIM_PTR_INT__i_s_n_s);
1417 contract(1296, shelloffsets, PRIM_INT__k_s_k_s, PRIM_PTR_INT__k_s_k_s);
1418 contract(1620, shelloffsets, PRIM_INT__k_s_l_s, PRIM_PTR_INT__k_s_l_s);
1419 contract(1980, shelloffsets, PRIM_INT__k_s_m_s, PRIM_PTR_INT__k_s_m_s);
1420 contract(2376, shelloffsets, PRIM_INT__k_s_n_s, PRIM_PTR_INT__k_s_n_s);
1421 contract(1620, shelloffsets, PRIM_INT__l_s_k_s, PRIM_PTR_INT__l_s_k_s);
1422 contract(2025, shelloffsets, PRIM_INT__l_s_l_s, PRIM_PTR_INT__l_s_l_s);
1423 contract(2475, shelloffsets, PRIM_INT__l_s_m_s, PRIM_PTR_INT__l_s_m_s);
1424 contract(2970, shelloffsets, PRIM_INT__l_s_n_s, PRIM_PTR_INT__l_s_n_s);
1425 contract(1980, shelloffsets, PRIM_INT__m_s_k_s, PRIM_PTR_INT__m_s_k_s);
1426 contract(2475, shelloffsets, PRIM_INT__m_s_l_s, PRIM_PTR_INT__m_s_l_s);
1427 contract(3025, shelloffsets, PRIM_INT__m_s_m_s, PRIM_PTR_INT__m_s_m_s);
1428 contract(3630, shelloffsets, PRIM_INT__m_s_n_s, PRIM_PTR_INT__m_s_n_s);
1429 contract(2376, shelloffsets, PRIM_INT__n_s_k_s, PRIM_PTR_INT__n_s_k_s);
1430 contract(2970, shelloffsets, PRIM_INT__n_s_l_s, PRIM_PTR_INT__n_s_l_s);
1431 contract(3630, shelloffsets, PRIM_INT__n_s_m_s, PRIM_PTR_INT__n_s_m_s);
1432 contract(4356, shelloffsets, PRIM_INT__n_s_n_s, PRIM_PTR_INT__n_s_n_s);
1433 contract(2808, shelloffsets, PRIM_INT__o_s_k_s, PRIM_PTR_INT__o_s_k_s);
1434 contract(3510, shelloffsets, PRIM_INT__o_s_l_s, PRIM_PTR_INT__o_s_l_s);
1435 contract(4290, shelloffsets, PRIM_INT__o_s_m_s, PRIM_PTR_INT__o_s_m_s);
1436 contract(5148, shelloffsets, PRIM_INT__o_s_n_s, PRIM_PTR_INT__o_s_n_s);
1437 PRIM_PTR_INT__i_s_k_s += lastoffset*1008;
1438 PRIM_PTR_INT__i_s_l_s += lastoffset*1260;
1439 PRIM_PTR_INT__i_s_m_s += lastoffset*1540;
1440 PRIM_PTR_INT__i_s_n_s += lastoffset*1848;
1441 PRIM_PTR_INT__k_s_k_s += lastoffset*1296;
1442 PRIM_PTR_INT__k_s_l_s += lastoffset*1620;
1443 PRIM_PTR_INT__k_s_m_s += lastoffset*1980;
1444 PRIM_PTR_INT__k_s_n_s += lastoffset*2376;
1445 PRIM_PTR_INT__l_s_k_s += lastoffset*1620;
1446 PRIM_PTR_INT__l_s_l_s += lastoffset*2025;
1447 PRIM_PTR_INT__l_s_m_s += lastoffset*2475;
1448 PRIM_PTR_INT__l_s_n_s += lastoffset*2970;
1449 PRIM_PTR_INT__m_s_k_s += lastoffset*1980;
1450 PRIM_PTR_INT__m_s_l_s += lastoffset*2475;
1451 PRIM_PTR_INT__m_s_m_s += lastoffset*3025;
1452 PRIM_PTR_INT__m_s_n_s += lastoffset*3630;
1453 PRIM_PTR_INT__n_s_k_s += lastoffset*2376;
1454 PRIM_PTR_INT__n_s_l_s += lastoffset*2970;
1455 PRIM_PTR_INT__n_s_m_s += lastoffset*3630;
1456 PRIM_PTR_INT__n_s_n_s += lastoffset*4356;
1457 PRIM_PTR_INT__o_s_k_s += lastoffset*2808;
1458 PRIM_PTR_INT__o_s_l_s += lastoffset*3510;
1459 PRIM_PTR_INT__o_s_m_s += lastoffset*4290;
1460 PRIM_PTR_INT__o_s_n_s += lastoffset*5148;
1461 }
1462
1463 } // close loop over j
1464 } // close loop over i
1465
1466 //Advance to the next batch
1467 jstart = SIMINT_SIMD_ROUND(jend);
1468
1469 //////////////////////////////////////////////
1470 // Contracted integrals: Horizontal recurrance
1471 //////////////////////////////////////////////
1472
1473
1474 const double hAB[3] = { P.AB_x[ab], P.AB_y[ab], P.AB_z[ab] };
1475
1476
1477 for(abcd = 0; abcd < nshellbatch; ++abcd, ++real_abcd)
1478 {
1479 const double hCD[3] = { Q.AB_x[cd+abcd], Q.AB_y[cd+abcd], Q.AB_z[cd+abcd] };
1480
1481 // set up HRR pointers
1482 double const * restrict HRR_INT__i_s_k_s = INT__i_s_k_s + abcd * 1008;
1483 double const * restrict HRR_INT__i_s_l_s = INT__i_s_l_s + abcd * 1260;
1484 double const * restrict HRR_INT__i_s_m_s = INT__i_s_m_s + abcd * 1540;
1485 double const * restrict HRR_INT__i_s_n_s = INT__i_s_n_s + abcd * 1848;
1486 double const * restrict HRR_INT__k_s_k_s = INT__k_s_k_s + abcd * 1296;
1487 double const * restrict HRR_INT__k_s_l_s = INT__k_s_l_s + abcd * 1620;
1488 double const * restrict HRR_INT__k_s_m_s = INT__k_s_m_s + abcd * 1980;
1489 double const * restrict HRR_INT__k_s_n_s = INT__k_s_n_s + abcd * 2376;
1490 double const * restrict HRR_INT__l_s_k_s = INT__l_s_k_s + abcd * 1620;
1491 double const * restrict HRR_INT__l_s_l_s = INT__l_s_l_s + abcd * 2025;
1492 double const * restrict HRR_INT__l_s_m_s = INT__l_s_m_s + abcd * 2475;
1493 double const * restrict HRR_INT__l_s_n_s = INT__l_s_n_s + abcd * 2970;
1494 double const * restrict HRR_INT__m_s_k_s = INT__m_s_k_s + abcd * 1980;
1495 double const * restrict HRR_INT__m_s_l_s = INT__m_s_l_s + abcd * 2475;
1496 double const * restrict HRR_INT__m_s_m_s = INT__m_s_m_s + abcd * 3025;
1497 double const * restrict HRR_INT__m_s_n_s = INT__m_s_n_s + abcd * 3630;
1498 double const * restrict HRR_INT__n_s_k_s = INT__n_s_k_s + abcd * 2376;
1499 double const * restrict HRR_INT__n_s_l_s = INT__n_s_l_s + abcd * 2970;
1500 double const * restrict HRR_INT__n_s_m_s = INT__n_s_m_s + abcd * 3630;
1501 double const * restrict HRR_INT__n_s_n_s = INT__n_s_n_s + abcd * 4356;
1502 double const * restrict HRR_INT__o_s_k_s = INT__o_s_k_s + abcd * 2808;
1503 double const * restrict HRR_INT__o_s_l_s = INT__o_s_l_s + abcd * 3510;
1504 double const * restrict HRR_INT__o_s_m_s = INT__o_s_m_s + abcd * 4290;
1505 double const * restrict HRR_INT__o_s_n_s = INT__o_s_n_s + abcd * 5148;
1506 double * restrict HRR_INT__i_h_k_f = INT__i_h_k_f + real_abcd * 211680;
1507
1508 // form INT__i_p_k_s
1509 ostei_general_hrr_J(6, 1, 7, 0, hAB, HRR_INT__k_s_k_s, HRR_INT__i_s_k_s, HRR_INT__i_p_k_s);
1510
1511 // form INT__i_p_l_s
1512 ostei_general_hrr_J(6, 1, 8, 0, hAB, HRR_INT__k_s_l_s, HRR_INT__i_s_l_s, HRR_INT__i_p_l_s);
1513
1514 // form INT__i_p_m_s
1515 ostei_general_hrr_J(6, 1, 9, 0, hAB, HRR_INT__k_s_m_s, HRR_INT__i_s_m_s, HRR_INT__i_p_m_s);
1516
1517 // form INT__i_p_n_s
1518 ostei_general_hrr_J(6, 1, 10, 0, hAB, HRR_INT__k_s_n_s, HRR_INT__i_s_n_s, HRR_INT__i_p_n_s);
1519
1520 // form INT__k_p_k_s
1521 ostei_general_hrr_J(7, 1, 7, 0, hAB, HRR_INT__l_s_k_s, HRR_INT__k_s_k_s, HRR_INT__k_p_k_s);
1522
1523 // form INT__k_p_l_s
1524 ostei_general_hrr_J(7, 1, 8, 0, hAB, HRR_INT__l_s_l_s, HRR_INT__k_s_l_s, HRR_INT__k_p_l_s);
1525
1526 // form INT__k_p_m_s
1527 ostei_general_hrr_J(7, 1, 9, 0, hAB, HRR_INT__l_s_m_s, HRR_INT__k_s_m_s, HRR_INT__k_p_m_s);
1528
1529 // form INT__k_p_n_s
1530 ostei_general_hrr_J(7, 1, 10, 0, hAB, HRR_INT__l_s_n_s, HRR_INT__k_s_n_s, HRR_INT__k_p_n_s);
1531
1532 // form INT__l_p_k_s
1533 ostei_general_hrr_J(8, 1, 7, 0, hAB, HRR_INT__m_s_k_s, HRR_INT__l_s_k_s, HRR_INT__l_p_k_s);
1534
1535 // form INT__l_p_l_s
1536 ostei_general_hrr_J(8, 1, 8, 0, hAB, HRR_INT__m_s_l_s, HRR_INT__l_s_l_s, HRR_INT__l_p_l_s);
1537
1538 // form INT__l_p_m_s
1539 ostei_general_hrr_J(8, 1, 9, 0, hAB, HRR_INT__m_s_m_s, HRR_INT__l_s_m_s, HRR_INT__l_p_m_s);
1540
1541 // form INT__l_p_n_s
1542 ostei_general_hrr_J(8, 1, 10, 0, hAB, HRR_INT__m_s_n_s, HRR_INT__l_s_n_s, HRR_INT__l_p_n_s);
1543
1544 // form INT__m_p_k_s
1545 ostei_general_hrr_J(9, 1, 7, 0, hAB, HRR_INT__n_s_k_s, HRR_INT__m_s_k_s, HRR_INT__m_p_k_s);
1546
1547 // form INT__m_p_l_s
1548 ostei_general_hrr_J(9, 1, 8, 0, hAB, HRR_INT__n_s_l_s, HRR_INT__m_s_l_s, HRR_INT__m_p_l_s);
1549
1550 // form INT__m_p_m_s
1551 ostei_general_hrr_J(9, 1, 9, 0, hAB, HRR_INT__n_s_m_s, HRR_INT__m_s_m_s, HRR_INT__m_p_m_s);
1552
1553 // form INT__m_p_n_s
1554 ostei_general_hrr_J(9, 1, 10, 0, hAB, HRR_INT__n_s_n_s, HRR_INT__m_s_n_s, HRR_INT__m_p_n_s);
1555
1556 // form INT__n_p_k_s
1557 ostei_general_hrr_J(10, 1, 7, 0, hAB, HRR_INT__o_s_k_s, HRR_INT__n_s_k_s, HRR_INT__n_p_k_s);
1558
1559 // form INT__n_p_l_s
1560 ostei_general_hrr_J(10, 1, 8, 0, hAB, HRR_INT__o_s_l_s, HRR_INT__n_s_l_s, HRR_INT__n_p_l_s);
1561
1562 // form INT__n_p_m_s
1563 ostei_general_hrr_J(10, 1, 9, 0, hAB, HRR_INT__o_s_m_s, HRR_INT__n_s_m_s, HRR_INT__n_p_m_s);
1564
1565 // form INT__n_p_n_s
1566 ostei_general_hrr_J(10, 1, 10, 0, hAB, HRR_INT__o_s_n_s, HRR_INT__n_s_n_s, HRR_INT__n_p_n_s);
1567
1568 // form INT__i_d_k_s
1569 ostei_general_hrr_J(6, 2, 7, 0, hAB, HRR_INT__k_p_k_s, HRR_INT__i_p_k_s, HRR_INT__i_d_k_s);
1570
1571 // form INT__i_d_l_s
1572 ostei_general_hrr_J(6, 2, 8, 0, hAB, HRR_INT__k_p_l_s, HRR_INT__i_p_l_s, HRR_INT__i_d_l_s);
1573
1574 // form INT__i_d_m_s
1575 ostei_general_hrr_J(6, 2, 9, 0, hAB, HRR_INT__k_p_m_s, HRR_INT__i_p_m_s, HRR_INT__i_d_m_s);
1576
1577 // form INT__i_d_n_s
1578 ostei_general_hrr_J(6, 2, 10, 0, hAB, HRR_INT__k_p_n_s, HRR_INT__i_p_n_s, HRR_INT__i_d_n_s);
1579
1580 // form INT__k_d_k_s
1581 ostei_general_hrr_J(7, 2, 7, 0, hAB, HRR_INT__l_p_k_s, HRR_INT__k_p_k_s, HRR_INT__k_d_k_s);
1582
1583 // form INT__k_d_l_s
1584 ostei_general_hrr_J(7, 2, 8, 0, hAB, HRR_INT__l_p_l_s, HRR_INT__k_p_l_s, HRR_INT__k_d_l_s);
1585
1586 // form INT__k_d_m_s
1587 ostei_general_hrr_J(7, 2, 9, 0, hAB, HRR_INT__l_p_m_s, HRR_INT__k_p_m_s, HRR_INT__k_d_m_s);
1588
1589 // form INT__k_d_n_s
1590 ostei_general_hrr_J(7, 2, 10, 0, hAB, HRR_INT__l_p_n_s, HRR_INT__k_p_n_s, HRR_INT__k_d_n_s);
1591
1592 // form INT__l_d_k_s
1593 ostei_general_hrr_J(8, 2, 7, 0, hAB, HRR_INT__m_p_k_s, HRR_INT__l_p_k_s, HRR_INT__l_d_k_s);
1594
1595 // form INT__l_d_l_s
1596 ostei_general_hrr_J(8, 2, 8, 0, hAB, HRR_INT__m_p_l_s, HRR_INT__l_p_l_s, HRR_INT__l_d_l_s);
1597
1598 // form INT__l_d_m_s
1599 ostei_general_hrr_J(8, 2, 9, 0, hAB, HRR_INT__m_p_m_s, HRR_INT__l_p_m_s, HRR_INT__l_d_m_s);
1600
1601 // form INT__l_d_n_s
1602 ostei_general_hrr_J(8, 2, 10, 0, hAB, HRR_INT__m_p_n_s, HRR_INT__l_p_n_s, HRR_INT__l_d_n_s);
1603
1604 // form INT__m_d_k_s
1605 ostei_general_hrr_J(9, 2, 7, 0, hAB, HRR_INT__n_p_k_s, HRR_INT__m_p_k_s, HRR_INT__m_d_k_s);
1606
1607 // form INT__m_d_l_s
1608 ostei_general_hrr_J(9, 2, 8, 0, hAB, HRR_INT__n_p_l_s, HRR_INT__m_p_l_s, HRR_INT__m_d_l_s);
1609
1610 // form INT__m_d_m_s
1611 ostei_general_hrr_J(9, 2, 9, 0, hAB, HRR_INT__n_p_m_s, HRR_INT__m_p_m_s, HRR_INT__m_d_m_s);
1612
1613 // form INT__m_d_n_s
1614 ostei_general_hrr_J(9, 2, 10, 0, hAB, HRR_INT__n_p_n_s, HRR_INT__m_p_n_s, HRR_INT__m_d_n_s);
1615
1616 // form INT__i_f_k_s
1617 ostei_general_hrr_J(6, 3, 7, 0, hAB, HRR_INT__k_d_k_s, HRR_INT__i_d_k_s, HRR_INT__i_f_k_s);
1618
1619 // form INT__i_f_l_s
1620 ostei_general_hrr_J(6, 3, 8, 0, hAB, HRR_INT__k_d_l_s, HRR_INT__i_d_l_s, HRR_INT__i_f_l_s);
1621
1622 // form INT__i_f_m_s
1623 ostei_general_hrr_J(6, 3, 9, 0, hAB, HRR_INT__k_d_m_s, HRR_INT__i_d_m_s, HRR_INT__i_f_m_s);
1624
1625 // form INT__i_f_n_s
1626 ostei_general_hrr_J(6, 3, 10, 0, hAB, HRR_INT__k_d_n_s, HRR_INT__i_d_n_s, HRR_INT__i_f_n_s);
1627
1628 // form INT__k_f_k_s
1629 ostei_general_hrr_J(7, 3, 7, 0, hAB, HRR_INT__l_d_k_s, HRR_INT__k_d_k_s, HRR_INT__k_f_k_s);
1630
1631 // form INT__k_f_l_s
1632 ostei_general_hrr_J(7, 3, 8, 0, hAB, HRR_INT__l_d_l_s, HRR_INT__k_d_l_s, HRR_INT__k_f_l_s);
1633
1634 // form INT__k_f_m_s
1635 ostei_general_hrr_J(7, 3, 9, 0, hAB, HRR_INT__l_d_m_s, HRR_INT__k_d_m_s, HRR_INT__k_f_m_s);
1636
1637 // form INT__k_f_n_s
1638 ostei_general_hrr_J(7, 3, 10, 0, hAB, HRR_INT__l_d_n_s, HRR_INT__k_d_n_s, HRR_INT__k_f_n_s);
1639
1640 // form INT__l_f_k_s
1641 ostei_general_hrr_J(8, 3, 7, 0, hAB, HRR_INT__m_d_k_s, HRR_INT__l_d_k_s, HRR_INT__l_f_k_s);
1642
1643 // form INT__l_f_l_s
1644 ostei_general_hrr_J(8, 3, 8, 0, hAB, HRR_INT__m_d_l_s, HRR_INT__l_d_l_s, HRR_INT__l_f_l_s);
1645
1646 // form INT__l_f_m_s
1647 ostei_general_hrr_J(8, 3, 9, 0, hAB, HRR_INT__m_d_m_s, HRR_INT__l_d_m_s, HRR_INT__l_f_m_s);
1648
1649 // form INT__l_f_n_s
1650 ostei_general_hrr_J(8, 3, 10, 0, hAB, HRR_INT__m_d_n_s, HRR_INT__l_d_n_s, HRR_INT__l_f_n_s);
1651
1652 // form INT__i_g_k_s
1653 ostei_general_hrr_J(6, 4, 7, 0, hAB, HRR_INT__k_f_k_s, HRR_INT__i_f_k_s, HRR_INT__i_g_k_s);
1654
1655 // form INT__i_g_l_s
1656 ostei_general_hrr_J(6, 4, 8, 0, hAB, HRR_INT__k_f_l_s, HRR_INT__i_f_l_s, HRR_INT__i_g_l_s);
1657
1658 // form INT__i_g_m_s
1659 ostei_general_hrr_J(6, 4, 9, 0, hAB, HRR_INT__k_f_m_s, HRR_INT__i_f_m_s, HRR_INT__i_g_m_s);
1660
1661 // form INT__i_g_n_s
1662 ostei_general_hrr_J(6, 4, 10, 0, hAB, HRR_INT__k_f_n_s, HRR_INT__i_f_n_s, HRR_INT__i_g_n_s);
1663
1664 // form INT__k_g_k_s
1665 ostei_general_hrr_J(7, 4, 7, 0, hAB, HRR_INT__l_f_k_s, HRR_INT__k_f_k_s, HRR_INT__k_g_k_s);
1666
1667 // form INT__k_g_l_s
1668 ostei_general_hrr_J(7, 4, 8, 0, hAB, HRR_INT__l_f_l_s, HRR_INT__k_f_l_s, HRR_INT__k_g_l_s);
1669
1670 // form INT__k_g_m_s
1671 ostei_general_hrr_J(7, 4, 9, 0, hAB, HRR_INT__l_f_m_s, HRR_INT__k_f_m_s, HRR_INT__k_g_m_s);
1672
1673 // form INT__k_g_n_s
1674 ostei_general_hrr_J(7, 4, 10, 0, hAB, HRR_INT__l_f_n_s, HRR_INT__k_f_n_s, HRR_INT__k_g_n_s);
1675
1676 // form INT__i_h_k_s
1677 ostei_general_hrr_J(6, 5, 7, 0, hAB, HRR_INT__k_g_k_s, HRR_INT__i_g_k_s, HRR_INT__i_h_k_s);
1678
1679 // form INT__i_h_l_s
1680 ostei_general_hrr_J(6, 5, 8, 0, hAB, HRR_INT__k_g_l_s, HRR_INT__i_g_l_s, HRR_INT__i_h_l_s);
1681
1682 // form INT__i_h_m_s
1683 ostei_general_hrr_J(6, 5, 9, 0, hAB, HRR_INT__k_g_m_s, HRR_INT__i_g_m_s, HRR_INT__i_h_m_s);
1684
1685 // form INT__i_h_n_s
1686 ostei_general_hrr_J(6, 5, 10, 0, hAB, HRR_INT__k_g_n_s, HRR_INT__i_g_n_s, HRR_INT__i_h_n_s);
1687
1688 // form INT__i_h_k_p
1689 ostei_general_hrr_L(6, 5, 7, 1, hCD, HRR_INT__i_h_l_s, HRR_INT__i_h_k_s, HRR_INT__i_h_k_p);
1690
1691 // form INT__i_h_l_p
1692 ostei_general_hrr_L(6, 5, 8, 1, hCD, HRR_INT__i_h_m_s, HRR_INT__i_h_l_s, HRR_INT__i_h_l_p);
1693
1694 // form INT__i_h_m_p
1695 ostei_general_hrr_L(6, 5, 9, 1, hCD, HRR_INT__i_h_n_s, HRR_INT__i_h_m_s, HRR_INT__i_h_m_p);
1696
1697 // form INT__i_h_k_d
1698 ostei_general_hrr_L(6, 5, 7, 2, hCD, HRR_INT__i_h_l_p, HRR_INT__i_h_k_p, HRR_INT__i_h_k_d);
1699
1700 // form INT__i_h_l_d
1701 ostei_general_hrr_L(6, 5, 8, 2, hCD, HRR_INT__i_h_m_p, HRR_INT__i_h_l_p, HRR_INT__i_h_l_d);
1702
1703 // form INT__i_h_k_f
1704 ostei_general_hrr_L(6, 5, 7, 3, hCD, HRR_INT__i_h_l_d, HRR_INT__i_h_k_d, HRR_INT__i_h_k_f);
1705
1706
1707 } // close HRR loop
1708
1709
1710 } // close loop cdbatch
1711
1712 istart = iend;
1713 } // close loop over ab
1714
1715 return P.nshell12_clip * Q.nshell12_clip;
1716 }
1717
ostei_h_i_k_f(struct simint_multi_shellpair const P,struct simint_multi_shellpair const Q,double screen_tol,double * const restrict work,double * const restrict INT__h_i_k_f)1718 int ostei_h_i_k_f(struct simint_multi_shellpair const P,
1719 struct simint_multi_shellpair const Q,
1720 double screen_tol,
1721 double * const restrict work,
1722 double * const restrict INT__h_i_k_f)
1723 {
1724 double P_AB[3*P.nshell12];
1725 struct simint_multi_shellpair P_tmp = P;
1726 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z;
1727 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z;
1728 P_tmp.AB_x = P_AB;
1729 P_tmp.AB_y = P_AB + P.nshell12;
1730 P_tmp.AB_z = P_AB + 2*P.nshell12;
1731
1732 for(int i = 0; i < P.nshell12; i++)
1733 {
1734 P_tmp.AB_x[i] = -P.AB_x[i];
1735 P_tmp.AB_y[i] = -P.AB_y[i];
1736 P_tmp.AB_z[i] = -P.AB_z[i];
1737 }
1738
1739 int ret = ostei_i_h_k_f(P_tmp, Q, screen_tol, work, INT__h_i_k_f);
1740 double buffer[211680] SIMINT_ALIGN_ARRAY_DBL;
1741
1742 for(int q = 0; q < ret; q++)
1743 {
1744 int idx = 0;
1745 for(int a = 0; a < 21; ++a)
1746 for(int b = 0; b < 28; ++b)
1747 for(int c = 0; c < 36; ++c)
1748 for(int d = 0; d < 10; ++d)
1749 buffer[idx++] = INT__h_i_k_f[q*211680+b*7560+a*360+c*10+d];
1750
1751 memcpy(INT__h_i_k_f+q*211680, buffer, 211680*sizeof(double));
1752 }
1753
1754 return ret;
1755 }
1756
ostei_i_h_f_k(struct simint_multi_shellpair const P,struct simint_multi_shellpair const Q,double screen_tol,double * const restrict work,double * const restrict INT__i_h_f_k)1757 int ostei_i_h_f_k(struct simint_multi_shellpair const P,
1758 struct simint_multi_shellpair const Q,
1759 double screen_tol,
1760 double * const restrict work,
1761 double * const restrict INT__i_h_f_k)
1762 {
1763 double Q_AB[3*Q.nshell12];
1764 struct simint_multi_shellpair Q_tmp = Q;
1765 Q_tmp.PA_x = Q.PB_x; Q_tmp.PA_y = Q.PB_y; Q_tmp.PA_z = Q.PB_z;
1766 Q_tmp.PB_x = Q.PA_x; Q_tmp.PB_y = Q.PA_y; Q_tmp.PB_z = Q.PA_z;
1767 Q_tmp.AB_x = Q_AB;
1768 Q_tmp.AB_y = Q_AB + Q.nshell12;
1769 Q_tmp.AB_z = Q_AB + 2*Q.nshell12;
1770
1771 for(int i = 0; i < Q.nshell12; i++)
1772 {
1773 Q_tmp.AB_x[i] = -Q.AB_x[i];
1774 Q_tmp.AB_y[i] = -Q.AB_y[i];
1775 Q_tmp.AB_z[i] = -Q.AB_z[i];
1776 }
1777
1778 int ret = ostei_i_h_k_f(P, Q_tmp, screen_tol, work, INT__i_h_f_k);
1779 double buffer[211680] SIMINT_ALIGN_ARRAY_DBL;
1780
1781 for(int q = 0; q < ret; q++)
1782 {
1783 int idx = 0;
1784 for(int a = 0; a < 28; ++a)
1785 for(int b = 0; b < 21; ++b)
1786 for(int c = 0; c < 10; ++c)
1787 for(int d = 0; d < 36; ++d)
1788 buffer[idx++] = INT__i_h_f_k[q*211680+a*7560+b*360+d*10+c];
1789
1790 memcpy(INT__i_h_f_k+q*211680, buffer, 211680*sizeof(double));
1791 }
1792
1793 return ret;
1794 }
1795
ostei_h_i_f_k(struct simint_multi_shellpair const P,struct simint_multi_shellpair const Q,double screen_tol,double * const restrict work,double * const restrict INT__h_i_f_k)1796 int ostei_h_i_f_k(struct simint_multi_shellpair const P,
1797 struct simint_multi_shellpair const Q,
1798 double screen_tol,
1799 double * const restrict work,
1800 double * const restrict INT__h_i_f_k)
1801 {
1802 double P_AB[3*P.nshell12];
1803 struct simint_multi_shellpair P_tmp = P;
1804 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z;
1805 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z;
1806 P_tmp.AB_x = P_AB;
1807 P_tmp.AB_y = P_AB + P.nshell12;
1808 P_tmp.AB_z = P_AB + 2*P.nshell12;
1809
1810 for(int i = 0; i < P.nshell12; i++)
1811 {
1812 P_tmp.AB_x[i] = -P.AB_x[i];
1813 P_tmp.AB_y[i] = -P.AB_y[i];
1814 P_tmp.AB_z[i] = -P.AB_z[i];
1815 }
1816
1817 double Q_AB[3*Q.nshell12];
1818 struct simint_multi_shellpair Q_tmp = Q;
1819 Q_tmp.PA_x = Q.PB_x; Q_tmp.PA_y = Q.PB_y; Q_tmp.PA_z = Q.PB_z;
1820 Q_tmp.PB_x = Q.PA_x; Q_tmp.PB_y = Q.PA_y; Q_tmp.PB_z = Q.PA_z;
1821 Q_tmp.AB_x = Q_AB;
1822 Q_tmp.AB_y = Q_AB + Q.nshell12;
1823 Q_tmp.AB_z = Q_AB + 2*Q.nshell12;
1824
1825 for(int i = 0; i < Q.nshell12; i++)
1826 {
1827 Q_tmp.AB_x[i] = -Q.AB_x[i];
1828 Q_tmp.AB_y[i] = -Q.AB_y[i];
1829 Q_tmp.AB_z[i] = -Q.AB_z[i];
1830 }
1831
1832 int ret = ostei_i_h_k_f(P_tmp, Q_tmp, screen_tol, work, INT__h_i_f_k);
1833 double buffer[211680] SIMINT_ALIGN_ARRAY_DBL;
1834
1835 for(int q = 0; q < ret; q++)
1836 {
1837 int idx = 0;
1838 for(int a = 0; a < 21; ++a)
1839 for(int b = 0; b < 28; ++b)
1840 for(int c = 0; c < 10; ++c)
1841 for(int d = 0; d < 36; ++d)
1842 buffer[idx++] = INT__h_i_f_k[q*211680+b*7560+a*360+d*10+c];
1843
1844 memcpy(INT__h_i_f_k+q*211680, buffer, 211680*sizeof(double));
1845 }
1846
1847 return ret;
1848 }
1849
1850