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_d(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_d)8 int ostei_i_h_k_d(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_d)
13 {
14
15 SIMINT_ASSUME_ALIGN_DBL(work);
16 SIMINT_ASSUME_ALIGN_DBL(INT__i_h_k_d);
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__k_s_k_s = work + (SIMINT_NSHELL_SIMD * 3808);
33 double * const INT__k_s_l_s = work + (SIMINT_NSHELL_SIMD * 5104);
34 double * const INT__k_s_m_s = work + (SIMINT_NSHELL_SIMD * 6724);
35 double * const INT__l_s_k_s = work + (SIMINT_NSHELL_SIMD * 8704);
36 double * const INT__l_s_l_s = work + (SIMINT_NSHELL_SIMD * 10324);
37 double * const INT__l_s_m_s = work + (SIMINT_NSHELL_SIMD * 12349);
38 double * const INT__m_s_k_s = work + (SIMINT_NSHELL_SIMD * 14824);
39 double * const INT__m_s_l_s = work + (SIMINT_NSHELL_SIMD * 16804);
40 double * const INT__m_s_m_s = work + (SIMINT_NSHELL_SIMD * 19279);
41 double * const INT__n_s_k_s = work + (SIMINT_NSHELL_SIMD * 22304);
42 double * const INT__n_s_l_s = work + (SIMINT_NSHELL_SIMD * 24680);
43 double * const INT__n_s_m_s = work + (SIMINT_NSHELL_SIMD * 27650);
44 double * const INT__o_s_k_s = work + (SIMINT_NSHELL_SIMD * 31280);
45 double * const INT__o_s_l_s = work + (SIMINT_NSHELL_SIMD * 34088);
46 double * const INT__o_s_m_s = work + (SIMINT_NSHELL_SIMD * 37598);
47 SIMINT_DBLTYPE * const primwork = (SIMINT_DBLTYPE *)(work + SIMINT_NSHELL_SIMD*41888);
48 SIMINT_DBLTYPE * const restrict PRIM_INT__s_s_s_s = primwork + 0;
49 SIMINT_DBLTYPE * const restrict PRIM_INT__s_s_p_s = primwork + 21;
50 SIMINT_DBLTYPE * const restrict PRIM_INT__s_s_d_s = primwork + 48;
51 SIMINT_DBLTYPE * const restrict PRIM_INT__s_s_f_s = primwork + 96;
52 SIMINT_DBLTYPE * const restrict PRIM_INT__p_s_s_s = primwork + 166;
53 SIMINT_DBLTYPE * const restrict PRIM_INT__p_s_p_s = primwork + 226;
54 SIMINT_DBLTYPE * const restrict PRIM_INT__p_s_d_s = primwork + 307;
55 SIMINT_DBLTYPE * const restrict PRIM_INT__p_s_f_s = primwork + 451;
56 SIMINT_DBLTYPE * const restrict PRIM_INT__p_s_g_s = primwork + 661;
57 SIMINT_DBLTYPE * const restrict PRIM_INT__d_s_s_s = primwork + 931;
58 SIMINT_DBLTYPE * const restrict PRIM_INT__d_s_p_s = primwork + 1045;
59 SIMINT_DBLTYPE * const restrict PRIM_INT__d_s_d_s = primwork + 1207;
60 SIMINT_DBLTYPE * const restrict PRIM_INT__d_s_f_s = primwork + 1495;
61 SIMINT_DBLTYPE * const restrict PRIM_INT__d_s_g_s = primwork + 1915;
62 SIMINT_DBLTYPE * const restrict PRIM_INT__d_s_h_s = primwork + 2455;
63 SIMINT_DBLTYPE * const restrict PRIM_INT__f_s_s_s = primwork + 3085;
64 SIMINT_DBLTYPE * const restrict PRIM_INT__f_s_p_s = primwork + 3265;
65 SIMINT_DBLTYPE * const restrict PRIM_INT__f_s_d_s = primwork + 3535;
66 SIMINT_DBLTYPE * const restrict PRIM_INT__f_s_f_s = primwork + 4015;
67 SIMINT_DBLTYPE * const restrict PRIM_INT__f_s_g_s = primwork + 4715;
68 SIMINT_DBLTYPE * const restrict PRIM_INT__f_s_h_s = primwork + 5615;
69 SIMINT_DBLTYPE * const restrict PRIM_INT__f_s_i_s = primwork + 6665;
70 SIMINT_DBLTYPE * const restrict PRIM_INT__g_s_s_s = primwork + 7785;
71 SIMINT_DBLTYPE * const restrict PRIM_INT__g_s_p_s = primwork + 8040;
72 SIMINT_DBLTYPE * const restrict PRIM_INT__g_s_d_s = primwork + 8445;
73 SIMINT_DBLTYPE * const restrict PRIM_INT__g_s_f_s = primwork + 9165;
74 SIMINT_DBLTYPE * const restrict PRIM_INT__g_s_g_s = primwork + 10215;
75 SIMINT_DBLTYPE * const restrict PRIM_INT__g_s_h_s = primwork + 11565;
76 SIMINT_DBLTYPE * const restrict PRIM_INT__g_s_i_s = primwork + 13140;
77 SIMINT_DBLTYPE * const restrict PRIM_INT__g_s_k_s = primwork + 14820;
78 SIMINT_DBLTYPE * const restrict PRIM_INT__h_s_s_s = primwork + 16440;
79 SIMINT_DBLTYPE * const restrict PRIM_INT__h_s_p_s = primwork + 16776;
80 SIMINT_DBLTYPE * const restrict PRIM_INT__h_s_d_s = primwork + 17343;
81 SIMINT_DBLTYPE * const restrict PRIM_INT__h_s_f_s = primwork + 18351;
82 SIMINT_DBLTYPE * const restrict PRIM_INT__h_s_g_s = primwork + 19821;
83 SIMINT_DBLTYPE * const restrict PRIM_INT__h_s_h_s = primwork + 21711;
84 SIMINT_DBLTYPE * const restrict PRIM_INT__h_s_i_s = primwork + 23916;
85 SIMINT_DBLTYPE * const restrict PRIM_INT__h_s_k_s = primwork + 26268;
86 SIMINT_DBLTYPE * const restrict PRIM_INT__h_s_l_s = primwork + 28536;
87 SIMINT_DBLTYPE * const restrict PRIM_INT__i_s_s_s = primwork + 30426;
88 SIMINT_DBLTYPE * const restrict PRIM_INT__i_s_p_s = primwork + 30846;
89 SIMINT_DBLTYPE * const restrict PRIM_INT__i_s_d_s = primwork + 31602;
90 SIMINT_DBLTYPE * const restrict PRIM_INT__i_s_f_s = primwork + 32946;
91 SIMINT_DBLTYPE * const restrict PRIM_INT__i_s_g_s = primwork + 34906;
92 SIMINT_DBLTYPE * const restrict PRIM_INT__i_s_h_s = primwork + 37426;
93 SIMINT_DBLTYPE * const restrict PRIM_INT__i_s_i_s = primwork + 40366;
94 SIMINT_DBLTYPE * const restrict PRIM_INT__i_s_k_s = primwork + 43502;
95 SIMINT_DBLTYPE * const restrict PRIM_INT__i_s_l_s = primwork + 46526;
96 SIMINT_DBLTYPE * const restrict PRIM_INT__i_s_m_s = primwork + 49046;
97 SIMINT_DBLTYPE * const restrict PRIM_INT__k_s_s_s = primwork + 50586;
98 SIMINT_DBLTYPE * const restrict PRIM_INT__k_s_p_s = primwork + 51090;
99 SIMINT_DBLTYPE * const restrict PRIM_INT__k_s_d_s = primwork + 52062;
100 SIMINT_DBLTYPE * const restrict PRIM_INT__k_s_f_s = primwork + 53790;
101 SIMINT_DBLTYPE * const restrict PRIM_INT__k_s_g_s = primwork + 56310;
102 SIMINT_DBLTYPE * const restrict PRIM_INT__k_s_h_s = primwork + 59550;
103 SIMINT_DBLTYPE * const restrict PRIM_INT__k_s_i_s = primwork + 63330;
104 SIMINT_DBLTYPE * const restrict PRIM_INT__k_s_k_s = primwork + 67362;
105 SIMINT_DBLTYPE * const restrict PRIM_INT__k_s_l_s = primwork + 71250;
106 SIMINT_DBLTYPE * const restrict PRIM_INT__k_s_m_s = primwork + 74490;
107 SIMINT_DBLTYPE * const restrict PRIM_INT__l_s_s_s = primwork + 76470;
108 SIMINT_DBLTYPE * const restrict PRIM_INT__l_s_p_s = primwork + 77055;
109 SIMINT_DBLTYPE * const restrict PRIM_INT__l_s_d_s = primwork + 78270;
110 SIMINT_DBLTYPE * const restrict PRIM_INT__l_s_f_s = primwork + 80430;
111 SIMINT_DBLTYPE * const restrict PRIM_INT__l_s_g_s = primwork + 83580;
112 SIMINT_DBLTYPE * const restrict PRIM_INT__l_s_h_s = primwork + 87630;
113 SIMINT_DBLTYPE * const restrict PRIM_INT__l_s_i_s = primwork + 92355;
114 SIMINT_DBLTYPE * const restrict PRIM_INT__l_s_k_s = primwork + 97395;
115 SIMINT_DBLTYPE * const restrict PRIM_INT__l_s_l_s = primwork + 102255;
116 SIMINT_DBLTYPE * const restrict PRIM_INT__l_s_m_s = primwork + 106305;
117 SIMINT_DBLTYPE * const restrict PRIM_INT__m_s_s_s = primwork + 108780;
118 SIMINT_DBLTYPE * const restrict PRIM_INT__m_s_p_s = primwork + 109440;
119 SIMINT_DBLTYPE * const restrict PRIM_INT__m_s_d_s = primwork + 110925;
120 SIMINT_DBLTYPE * const restrict PRIM_INT__m_s_f_s = primwork + 113565;
121 SIMINT_DBLTYPE * const restrict PRIM_INT__m_s_g_s = primwork + 117415;
122 SIMINT_DBLTYPE * const restrict PRIM_INT__m_s_h_s = primwork + 122365;
123 SIMINT_DBLTYPE * const restrict PRIM_INT__m_s_i_s = primwork + 128140;
124 SIMINT_DBLTYPE * const restrict PRIM_INT__m_s_k_s = primwork + 134300;
125 SIMINT_DBLTYPE * const restrict PRIM_INT__m_s_l_s = primwork + 140240;
126 SIMINT_DBLTYPE * const restrict PRIM_INT__m_s_m_s = primwork + 145190;
127 SIMINT_DBLTYPE * const restrict PRIM_INT__n_s_s_s = primwork + 148215;
128 SIMINT_DBLTYPE * const restrict PRIM_INT__n_s_p_s = primwork + 148941;
129 SIMINT_DBLTYPE * const restrict PRIM_INT__n_s_d_s = primwork + 150723;
130 SIMINT_DBLTYPE * const restrict PRIM_INT__n_s_f_s = primwork + 153891;
131 SIMINT_DBLTYPE * const restrict PRIM_INT__n_s_g_s = primwork + 158511;
132 SIMINT_DBLTYPE * const restrict PRIM_INT__n_s_h_s = primwork + 164451;
133 SIMINT_DBLTYPE * const restrict PRIM_INT__n_s_i_s = primwork + 171381;
134 SIMINT_DBLTYPE * const restrict PRIM_INT__n_s_k_s = primwork + 178773;
135 SIMINT_DBLTYPE * const restrict PRIM_INT__n_s_l_s = primwork + 185901;
136 SIMINT_DBLTYPE * const restrict PRIM_INT__n_s_m_s = primwork + 191841;
137 SIMINT_DBLTYPE * const restrict PRIM_INT__o_s_s_s = primwork + 195471;
138 SIMINT_DBLTYPE * const restrict PRIM_INT__o_s_p_s = primwork + 196251;
139 SIMINT_DBLTYPE * const restrict PRIM_INT__o_s_d_s = primwork + 198357;
140 SIMINT_DBLTYPE * const restrict PRIM_INT__o_s_f_s = primwork + 202101;
141 SIMINT_DBLTYPE * const restrict PRIM_INT__o_s_g_s = primwork + 207561;
142 SIMINT_DBLTYPE * const restrict PRIM_INT__o_s_h_s = primwork + 214581;
143 SIMINT_DBLTYPE * const restrict PRIM_INT__o_s_i_s = primwork + 222771;
144 SIMINT_DBLTYPE * const restrict PRIM_INT__o_s_k_s = primwork + 231507;
145 SIMINT_DBLTYPE * const restrict PRIM_INT__o_s_l_s = primwork + 239931;
146 SIMINT_DBLTYPE * const restrict PRIM_INT__o_s_m_s = primwork + 246951;
147 double * const hrrwork = (double *)(primwork + 251241);
148 double * const HRR_INT__i_p_k_s = hrrwork + 0;
149 double * const HRR_INT__i_p_l_s = hrrwork + 3024;
150 double * const HRR_INT__i_p_m_s = hrrwork + 6804;
151 double * const HRR_INT__i_d_k_s = hrrwork + 11424;
152 double * const HRR_INT__i_d_l_s = hrrwork + 17472;
153 double * const HRR_INT__i_d_m_s = hrrwork + 25032;
154 double * const HRR_INT__i_f_k_s = hrrwork + 34272;
155 double * const HRR_INT__i_f_l_s = hrrwork + 44352;
156 double * const HRR_INT__i_f_m_s = hrrwork + 56952;
157 double * const HRR_INT__i_g_k_s = hrrwork + 72352;
158 double * const HRR_INT__i_g_l_s = hrrwork + 87472;
159 double * const HRR_INT__i_g_m_s = hrrwork + 106372;
160 double * const HRR_INT__i_h_k_s = hrrwork + 129472;
161 double * const HRR_INT__i_h_k_p = hrrwork + 150640;
162 double * const HRR_INT__i_h_l_s = hrrwork + 214144;
163 double * const HRR_INT__i_h_l_p = hrrwork + 240604;
164 double * const HRR_INT__i_h_m_s = hrrwork + 319984;
165 double * const HRR_INT__k_p_k_s = hrrwork + 352324;
166 double * const HRR_INT__k_p_l_s = hrrwork + 356212;
167 double * const HRR_INT__k_p_m_s = hrrwork + 361072;
168 double * const HRR_INT__k_d_k_s = hrrwork + 367012;
169 double * const HRR_INT__k_d_l_s = hrrwork + 374788;
170 double * const HRR_INT__k_d_m_s = hrrwork + 384508;
171 double * const HRR_INT__k_f_k_s = hrrwork + 396388;
172 double * const HRR_INT__k_f_l_s = hrrwork + 409348;
173 double * const HRR_INT__k_f_m_s = hrrwork + 425548;
174 double * const HRR_INT__k_g_k_s = hrrwork + 445348;
175 double * const HRR_INT__k_g_l_s = hrrwork + 464788;
176 double * const HRR_INT__k_g_m_s = hrrwork + 489088;
177 double * const HRR_INT__l_p_k_s = hrrwork + 518788;
178 double * const HRR_INT__l_p_l_s = hrrwork + 523648;
179 double * const HRR_INT__l_p_m_s = hrrwork + 529723;
180 double * const HRR_INT__l_d_k_s = hrrwork + 537148;
181 double * const HRR_INT__l_d_l_s = hrrwork + 546868;
182 double * const HRR_INT__l_d_m_s = hrrwork + 559018;
183 double * const HRR_INT__l_f_k_s = hrrwork + 573868;
184 double * const HRR_INT__l_f_l_s = hrrwork + 590068;
185 double * const HRR_INT__l_f_m_s = hrrwork + 610318;
186 double * const HRR_INT__m_p_k_s = hrrwork + 635068;
187 double * const HRR_INT__m_p_l_s = hrrwork + 641008;
188 double * const HRR_INT__m_p_m_s = hrrwork + 648433;
189 double * const HRR_INT__m_d_k_s = hrrwork + 657508;
190 double * const HRR_INT__m_d_l_s = hrrwork + 669388;
191 double * const HRR_INT__m_d_m_s = hrrwork + 684238;
192 double * const HRR_INT__n_p_k_s = hrrwork + 702388;
193 double * const HRR_INT__n_p_l_s = hrrwork + 709516;
194 double * const HRR_INT__n_p_m_s = hrrwork + 718426;
195
196
197 // Create constants
198 const SIMINT_DBLTYPE const_1 = SIMINT_DBLSET1(1);
199 const SIMINT_DBLTYPE const_10 = SIMINT_DBLSET1(10);
200 const SIMINT_DBLTYPE const_11 = SIMINT_DBLSET1(11);
201 const SIMINT_DBLTYPE const_2 = SIMINT_DBLSET1(2);
202 const SIMINT_DBLTYPE const_3 = SIMINT_DBLSET1(3);
203 const SIMINT_DBLTYPE const_4 = SIMINT_DBLSET1(4);
204 const SIMINT_DBLTYPE const_5 = SIMINT_DBLSET1(5);
205 const SIMINT_DBLTYPE const_6 = SIMINT_DBLSET1(6);
206 const SIMINT_DBLTYPE const_7 = SIMINT_DBLSET1(7);
207 const SIMINT_DBLTYPE const_8 = SIMINT_DBLSET1(8);
208 const SIMINT_DBLTYPE const_9 = SIMINT_DBLSET1(9);
209 const SIMINT_DBLTYPE one_half = SIMINT_DBLSET1(0.5);
210
211
212 ////////////////////////////////////////
213 // Loop over shells and primitives
214 ////////////////////////////////////////
215
216 real_abcd = 0;
217 istart = 0;
218 for(ab = 0; ab < P.nshell12_clip; ++ab)
219 {
220 const int iend = istart + P.nprim12[ab];
221
222 cd = 0;
223 jstart = 0;
224
225 for(cd = 0; cd < Q.nshell12_clip; cd += SIMINT_NSHELL_SIMD)
226 {
227 const int nshellbatch = ((cd + SIMINT_NSHELL_SIMD) > Q.nshell12_clip) ? Q.nshell12_clip - cd : SIMINT_NSHELL_SIMD;
228 int jend = jstart;
229 for(i = 0; i < nshellbatch; i++)
230 jend += Q.nprim12[cd+i];
231
232 // Clear the beginning of the workspace (where we are accumulating integrals)
233 memset(work, 0, SIMINT_NSHELL_SIMD * 41888 * sizeof(double));
234 abcd = 0;
235
236
237 for(i = istart; i < iend; ++i)
238 {
239 SIMINT_DBLTYPE bra_screen_max; // only used if check_screen
240
241 if(check_screen)
242 {
243 // Skip this whole thing if always insignificant
244 if((P.screen[i] * Q.screen_max) < screen_tol)
245 continue;
246 bra_screen_max = SIMINT_DBLSET1(P.screen[i]);
247 }
248
249 icd = 0;
250 iprimcd = 0;
251 nprim_icd = Q.nprim12[cd];
252 double * restrict PRIM_PTR_INT__i_s_k_s = INT__i_s_k_s + abcd * 1008;
253 double * restrict PRIM_PTR_INT__i_s_l_s = INT__i_s_l_s + abcd * 1260;
254 double * restrict PRIM_PTR_INT__i_s_m_s = INT__i_s_m_s + abcd * 1540;
255 double * restrict PRIM_PTR_INT__k_s_k_s = INT__k_s_k_s + abcd * 1296;
256 double * restrict PRIM_PTR_INT__k_s_l_s = INT__k_s_l_s + abcd * 1620;
257 double * restrict PRIM_PTR_INT__k_s_m_s = INT__k_s_m_s + abcd * 1980;
258 double * restrict PRIM_PTR_INT__l_s_k_s = INT__l_s_k_s + abcd * 1620;
259 double * restrict PRIM_PTR_INT__l_s_l_s = INT__l_s_l_s + abcd * 2025;
260 double * restrict PRIM_PTR_INT__l_s_m_s = INT__l_s_m_s + abcd * 2475;
261 double * restrict PRIM_PTR_INT__m_s_k_s = INT__m_s_k_s + abcd * 1980;
262 double * restrict PRIM_PTR_INT__m_s_l_s = INT__m_s_l_s + abcd * 2475;
263 double * restrict PRIM_PTR_INT__m_s_m_s = INT__m_s_m_s + abcd * 3025;
264 double * restrict PRIM_PTR_INT__n_s_k_s = INT__n_s_k_s + abcd * 2376;
265 double * restrict PRIM_PTR_INT__n_s_l_s = INT__n_s_l_s + abcd * 2970;
266 double * restrict PRIM_PTR_INT__n_s_m_s = INT__n_s_m_s + abcd * 3630;
267 double * restrict PRIM_PTR_INT__o_s_k_s = INT__o_s_k_s + abcd * 2808;
268 double * restrict PRIM_PTR_INT__o_s_l_s = INT__o_s_l_s + abcd * 3510;
269 double * restrict PRIM_PTR_INT__o_s_m_s = INT__o_s_m_s + abcd * 4290;
270
271
272
273 // Load these one per loop over i
274 const SIMINT_DBLTYPE P_alpha = SIMINT_DBLSET1(P.alpha[i]);
275 const SIMINT_DBLTYPE P_prefac = SIMINT_DBLSET1(P.prefac[i]);
276 const SIMINT_DBLTYPE Pxyz[3] = { SIMINT_DBLSET1(P.x[i]), SIMINT_DBLSET1(P.y[i]), SIMINT_DBLSET1(P.z[i]) };
277
278 const SIMINT_DBLTYPE P_PA[3] = { SIMINT_DBLSET1(P.PA_x[i]), SIMINT_DBLSET1(P.PA_y[i]), SIMINT_DBLSET1(P.PA_z[i]) };
279
280 for(j = jstart; j < jend; j += SIMINT_SIMD_LEN)
281 {
282 // calculate the shell offsets
283 // these are the offset from the shell pointed to by cd
284 // for each element
285 int shelloffsets[SIMINT_SIMD_LEN] = {0};
286 int lastoffset = 0;
287 const int nlane = ( ((j + SIMINT_SIMD_LEN) < jend) ? SIMINT_SIMD_LEN : (jend - j));
288
289 if((iprimcd + SIMINT_SIMD_LEN) >= nprim_icd)
290 {
291 // Handle if the first element of the vector is a new shell
292 if(iprimcd >= nprim_icd && ((icd+1) < nshellbatch))
293 {
294 nprim_icd += Q.nprim12[cd + (++icd)];
295 PRIM_PTR_INT__i_s_k_s += 1008;
296 PRIM_PTR_INT__i_s_l_s += 1260;
297 PRIM_PTR_INT__i_s_m_s += 1540;
298 PRIM_PTR_INT__k_s_k_s += 1296;
299 PRIM_PTR_INT__k_s_l_s += 1620;
300 PRIM_PTR_INT__k_s_m_s += 1980;
301 PRIM_PTR_INT__l_s_k_s += 1620;
302 PRIM_PTR_INT__l_s_l_s += 2025;
303 PRIM_PTR_INT__l_s_m_s += 2475;
304 PRIM_PTR_INT__m_s_k_s += 1980;
305 PRIM_PTR_INT__m_s_l_s += 2475;
306 PRIM_PTR_INT__m_s_m_s += 3025;
307 PRIM_PTR_INT__n_s_k_s += 2376;
308 PRIM_PTR_INT__n_s_l_s += 2970;
309 PRIM_PTR_INT__n_s_m_s += 3630;
310 PRIM_PTR_INT__o_s_k_s += 2808;
311 PRIM_PTR_INT__o_s_l_s += 3510;
312 PRIM_PTR_INT__o_s_m_s += 4290;
313 }
314 iprimcd++;
315 for(n = 1; n < SIMINT_SIMD_LEN; ++n)
316 {
317 if(iprimcd >= nprim_icd && ((icd+1) < nshellbatch))
318 {
319 shelloffsets[n] = shelloffsets[n-1] + 1;
320 lastoffset++;
321 nprim_icd += Q.nprim12[cd + (++icd)];
322 }
323 else
324 shelloffsets[n] = shelloffsets[n-1];
325 iprimcd++;
326 }
327 }
328 else
329 iprimcd += SIMINT_SIMD_LEN;
330
331 // Do we have to compute this vector (or has it been screened out)?
332 // (not_screened != 0 means we have to do this vector)
333 if(check_screen)
334 {
335 const double vmax = vector_max(SIMINT_MUL(bra_screen_max, SIMINT_DBLLOAD(Q.screen, j)));
336 if(vmax < screen_tol)
337 {
338 PRIM_PTR_INT__i_s_k_s += lastoffset*1008;
339 PRIM_PTR_INT__i_s_l_s += lastoffset*1260;
340 PRIM_PTR_INT__i_s_m_s += lastoffset*1540;
341 PRIM_PTR_INT__k_s_k_s += lastoffset*1296;
342 PRIM_PTR_INT__k_s_l_s += lastoffset*1620;
343 PRIM_PTR_INT__k_s_m_s += lastoffset*1980;
344 PRIM_PTR_INT__l_s_k_s += lastoffset*1620;
345 PRIM_PTR_INT__l_s_l_s += lastoffset*2025;
346 PRIM_PTR_INT__l_s_m_s += lastoffset*2475;
347 PRIM_PTR_INT__m_s_k_s += lastoffset*1980;
348 PRIM_PTR_INT__m_s_l_s += lastoffset*2475;
349 PRIM_PTR_INT__m_s_m_s += lastoffset*3025;
350 PRIM_PTR_INT__n_s_k_s += lastoffset*2376;
351 PRIM_PTR_INT__n_s_l_s += lastoffset*2970;
352 PRIM_PTR_INT__n_s_m_s += lastoffset*3630;
353 PRIM_PTR_INT__o_s_k_s += lastoffset*2808;
354 PRIM_PTR_INT__o_s_l_s += lastoffset*3510;
355 PRIM_PTR_INT__o_s_m_s += lastoffset*4290;
356 continue;
357 }
358 }
359
360 const SIMINT_DBLTYPE Q_alpha = SIMINT_DBLLOAD(Q.alpha, j);
361 const SIMINT_DBLTYPE PQalpha_mul = SIMINT_MUL(P_alpha, Q_alpha);
362 const SIMINT_DBLTYPE PQalpha_sum = SIMINT_ADD(P_alpha, Q_alpha);
363 const SIMINT_DBLTYPE one_over_PQalpha_sum = SIMINT_DIV(const_1, PQalpha_sum);
364
365
366 /* construct R2 = (Px - Qx)**2 + (Py - Qy)**2 + (Pz -Qz)**2 */
367 SIMINT_DBLTYPE PQ[3];
368 PQ[0] = SIMINT_SUB(Pxyz[0], SIMINT_DBLLOAD(Q.x, j));
369 PQ[1] = SIMINT_SUB(Pxyz[1], SIMINT_DBLLOAD(Q.y, j));
370 PQ[2] = SIMINT_SUB(Pxyz[2], SIMINT_DBLLOAD(Q.z, j));
371 SIMINT_DBLTYPE R2 = SIMINT_MUL(PQ[0], PQ[0]);
372 R2 = SIMINT_FMADD(PQ[1], PQ[1], R2);
373 R2 = SIMINT_FMADD(PQ[2], PQ[2], R2);
374
375 const SIMINT_DBLTYPE alpha = SIMINT_MUL(PQalpha_mul, one_over_PQalpha_sum); // alpha from MEST
376 const SIMINT_DBLTYPE one_over_p = SIMINT_DIV(const_1, P_alpha);
377 const SIMINT_DBLTYPE one_over_q = SIMINT_DIV(const_1, Q_alpha);
378 const SIMINT_DBLTYPE one_over_2p = SIMINT_MUL(one_half, one_over_p);
379 const SIMINT_DBLTYPE one_over_2q = SIMINT_MUL(one_half, one_over_q);
380 const SIMINT_DBLTYPE one_over_2pq = SIMINT_MUL(one_half, one_over_PQalpha_sum);
381 const SIMINT_DBLTYPE Q_PA[3] = { SIMINT_DBLLOAD(Q.PA_x, j), SIMINT_DBLLOAD(Q.PA_y, j), SIMINT_DBLLOAD(Q.PA_z, j) };
382
383 // NOTE: Minus sign!
384 const SIMINT_DBLTYPE a_over_p = SIMINT_MUL(SIMINT_NEG(alpha), one_over_p);
385 SIMINT_DBLTYPE aop_PQ[3];
386 aop_PQ[0] = SIMINT_MUL(a_over_p, PQ[0]);
387 aop_PQ[1] = SIMINT_MUL(a_over_p, PQ[1]);
388 aop_PQ[2] = SIMINT_MUL(a_over_p, PQ[2]);
389
390 SIMINT_DBLTYPE a_over_q = SIMINT_MUL(alpha, one_over_q);
391 SIMINT_DBLTYPE aoq_PQ[3];
392 aoq_PQ[0] = SIMINT_MUL(a_over_q, PQ[0]);
393 aoq_PQ[1] = SIMINT_MUL(a_over_q, PQ[1]);
394 aoq_PQ[2] = SIMINT_MUL(a_over_q, PQ[2]);
395 // Put a minus sign here so we don't have to in RR routines
396 a_over_q = SIMINT_NEG(a_over_q);
397
398
399 //////////////////////////////////////////////
400 // Fjt function section
401 // Maximum v value: 20
402 //////////////////////////////////////////////
403 // The parameter to the Fjt function
404 const SIMINT_DBLTYPE F_x = SIMINT_MUL(R2, alpha);
405
406
407 const SIMINT_DBLTYPE Q_prefac = mask_load(nlane, Q.prefac + j);
408
409
410 boys_F_split(PRIM_INT__s_s_s_s, F_x, 20);
411 SIMINT_DBLTYPE prefac = SIMINT_SQRT(one_over_PQalpha_sum);
412 prefac = SIMINT_MUL(SIMINT_MUL(P_prefac, Q_prefac), prefac);
413 for(n = 0; n <= 20; n++)
414 PRIM_INT__s_s_s_s[n] = SIMINT_MUL(PRIM_INT__s_s_s_s[n], prefac);
415
416 //////////////////////////////////////////////
417 // Primitive integrals: Vertical recurrance
418 //////////////////////////////////////////////
419
420 const SIMINT_DBLTYPE vrr_const_1_over_2p = one_over_2p;
421 const SIMINT_DBLTYPE vrr_const_2_over_2p = SIMINT_MUL(const_2, one_over_2p);
422 const SIMINT_DBLTYPE vrr_const_3_over_2p = SIMINT_MUL(const_3, one_over_2p);
423 const SIMINT_DBLTYPE vrr_const_4_over_2p = SIMINT_MUL(const_4, one_over_2p);
424 const SIMINT_DBLTYPE vrr_const_5_over_2p = SIMINT_MUL(const_5, one_over_2p);
425 const SIMINT_DBLTYPE vrr_const_6_over_2p = SIMINT_MUL(const_6, one_over_2p);
426 const SIMINT_DBLTYPE vrr_const_7_over_2p = SIMINT_MUL(const_7, one_over_2p);
427 const SIMINT_DBLTYPE vrr_const_8_over_2p = SIMINT_MUL(const_8, one_over_2p);
428 const SIMINT_DBLTYPE vrr_const_9_over_2p = SIMINT_MUL(const_9, one_over_2p);
429 const SIMINT_DBLTYPE vrr_const_10_over_2p = SIMINT_MUL(const_10, one_over_2p);
430 const SIMINT_DBLTYPE vrr_const_1_over_2q = one_over_2q;
431 const SIMINT_DBLTYPE vrr_const_2_over_2q = SIMINT_MUL(const_2, one_over_2q);
432 const SIMINT_DBLTYPE vrr_const_3_over_2q = SIMINT_MUL(const_3, one_over_2q);
433 const SIMINT_DBLTYPE vrr_const_4_over_2q = SIMINT_MUL(const_4, one_over_2q);
434 const SIMINT_DBLTYPE vrr_const_5_over_2q = SIMINT_MUL(const_5, one_over_2q);
435 const SIMINT_DBLTYPE vrr_const_6_over_2q = SIMINT_MUL(const_6, one_over_2q);
436 const SIMINT_DBLTYPE vrr_const_7_over_2q = SIMINT_MUL(const_7, one_over_2q);
437 const SIMINT_DBLTYPE vrr_const_8_over_2q = SIMINT_MUL(const_8, one_over_2q);
438 const SIMINT_DBLTYPE vrr_const_1_over_2pq = one_over_2pq;
439 const SIMINT_DBLTYPE vrr_const_2_over_2pq = SIMINT_MUL(const_2, one_over_2pq);
440 const SIMINT_DBLTYPE vrr_const_3_over_2pq = SIMINT_MUL(const_3, one_over_2pq);
441 const SIMINT_DBLTYPE vrr_const_4_over_2pq = SIMINT_MUL(const_4, one_over_2pq);
442 const SIMINT_DBLTYPE vrr_const_5_over_2pq = SIMINT_MUL(const_5, one_over_2pq);
443 const SIMINT_DBLTYPE vrr_const_6_over_2pq = SIMINT_MUL(const_6, one_over_2pq);
444 const SIMINT_DBLTYPE vrr_const_7_over_2pq = SIMINT_MUL(const_7, one_over_2pq);
445 const SIMINT_DBLTYPE vrr_const_8_over_2pq = SIMINT_MUL(const_8, one_over_2pq);
446 const SIMINT_DBLTYPE vrr_const_9_over_2pq = SIMINT_MUL(const_9, one_over_2pq);
447 const SIMINT_DBLTYPE vrr_const_10_over_2pq = SIMINT_MUL(const_10, one_over_2pq);
448 const SIMINT_DBLTYPE vrr_const_11_over_2pq = SIMINT_MUL(const_11, one_over_2pq);
449
450
451
452 // Forming PRIM_INT__p_s_s_s[20 * 3];
453 for(n = 0; n < 20; ++n) // loop over orders of auxiliary function
454 {
455
456 PRIM_INT__p_s_s_s[n * 3 + 0] = SIMINT_MUL(P_PA[0], PRIM_INT__s_s_s_s[n * 1 + 0]);
457 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]);
458
459 PRIM_INT__p_s_s_s[n * 3 + 1] = SIMINT_MUL(P_PA[1], PRIM_INT__s_s_s_s[n * 1 + 0]);
460 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]);
461
462 PRIM_INT__p_s_s_s[n * 3 + 2] = SIMINT_MUL(P_PA[2], PRIM_INT__s_s_s_s[n * 1 + 0]);
463 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]);
464
465 }
466
467
468
469 // Forming PRIM_INT__d_s_s_s[19 * 6];
470 for(n = 0; n < 19; ++n) // loop over orders of auxiliary function
471 {
472
473 PRIM_INT__d_s_s_s[n * 6 + 0] = SIMINT_MUL(P_PA[0], PRIM_INT__p_s_s_s[n * 3 + 0]);
474 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]);
475 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]);
476
477 PRIM_INT__d_s_s_s[n * 6 + 1] = SIMINT_MUL(P_PA[1], PRIM_INT__p_s_s_s[n * 3 + 0]);
478 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]);
479
480 PRIM_INT__d_s_s_s[n * 6 + 2] = SIMINT_MUL(P_PA[2], PRIM_INT__p_s_s_s[n * 3 + 0]);
481 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]);
482
483 PRIM_INT__d_s_s_s[n * 6 + 3] = SIMINT_MUL(P_PA[1], PRIM_INT__p_s_s_s[n * 3 + 1]);
484 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]);
485 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]);
486
487 PRIM_INT__d_s_s_s[n * 6 + 4] = SIMINT_MUL(P_PA[2], PRIM_INT__p_s_s_s[n * 3 + 1]);
488 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]);
489
490 PRIM_INT__d_s_s_s[n * 6 + 5] = SIMINT_MUL(P_PA[2], PRIM_INT__p_s_s_s[n * 3 + 2]);
491 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]);
492 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]);
493
494 }
495
496
497
498 // Forming PRIM_INT__f_s_s_s[18 * 10];
499 for(n = 0; n < 18; ++n) // loop over orders of auxiliary function
500 {
501
502 PRIM_INT__f_s_s_s[n * 10 + 0] = SIMINT_MUL(P_PA[0], PRIM_INT__d_s_s_s[n * 6 + 0]);
503 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]);
504 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]);
505
506 PRIM_INT__f_s_s_s[n * 10 + 1] = SIMINT_MUL(P_PA[1], PRIM_INT__d_s_s_s[n * 6 + 0]);
507 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]);
508
509 PRIM_INT__f_s_s_s[n * 10 + 2] = SIMINT_MUL(P_PA[2], PRIM_INT__d_s_s_s[n * 6 + 0]);
510 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]);
511
512 PRIM_INT__f_s_s_s[n * 10 + 3] = SIMINT_MUL(P_PA[0], PRIM_INT__d_s_s_s[n * 6 + 3]);
513 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]);
514
515 PRIM_INT__f_s_s_s[n * 10 + 4] = SIMINT_MUL(P_PA[2], PRIM_INT__d_s_s_s[n * 6 + 1]);
516 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]);
517
518 PRIM_INT__f_s_s_s[n * 10 + 5] = SIMINT_MUL(P_PA[0], PRIM_INT__d_s_s_s[n * 6 + 5]);
519 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]);
520
521 PRIM_INT__f_s_s_s[n * 10 + 6] = SIMINT_MUL(P_PA[1], PRIM_INT__d_s_s_s[n * 6 + 3]);
522 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]);
523 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]);
524
525 PRIM_INT__f_s_s_s[n * 10 + 7] = SIMINT_MUL(P_PA[2], PRIM_INT__d_s_s_s[n * 6 + 3]);
526 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]);
527
528 PRIM_INT__f_s_s_s[n * 10 + 8] = SIMINT_MUL(P_PA[1], PRIM_INT__d_s_s_s[n * 6 + 5]);
529 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]);
530
531 PRIM_INT__f_s_s_s[n * 10 + 9] = SIMINT_MUL(P_PA[2], PRIM_INT__d_s_s_s[n * 6 + 5]);
532 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]);
533 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]);
534
535 }
536
537
538 VRR_I_g_s_s_s(
539 PRIM_INT__g_s_s_s,
540 PRIM_INT__f_s_s_s,
541 PRIM_INT__d_s_s_s,
542 P_PA,
543 a_over_p,
544 aop_PQ,
545 one_over_2p,
546 17);
547
548
549 VRR_I_h_s_s_s(
550 PRIM_INT__h_s_s_s,
551 PRIM_INT__g_s_s_s,
552 PRIM_INT__f_s_s_s,
553 P_PA,
554 a_over_p,
555 aop_PQ,
556 one_over_2p,
557 16);
558
559
560 ostei_general_vrr1_I(6, 15,
561 one_over_2p, a_over_p, aop_PQ, P_PA,
562 PRIM_INT__h_s_s_s, PRIM_INT__g_s_s_s, PRIM_INT__i_s_s_s);
563
564
565 ostei_general_vrr_K(6, 0, 1, 0, 9,
566 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
567 PRIM_INT__i_s_s_s, NULL, NULL, PRIM_INT__h_s_s_s, NULL, PRIM_INT__i_s_p_s);
568
569
570 ostei_general_vrr_K(5, 0, 1, 0, 9,
571 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
572 PRIM_INT__h_s_s_s, NULL, NULL, PRIM_INT__g_s_s_s, NULL, PRIM_INT__h_s_p_s);
573
574
575 ostei_general_vrr_K(6, 0, 2, 0, 8,
576 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
577 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);
578
579
580 VRR_K_g_s_p_s(
581 PRIM_INT__g_s_p_s,
582 PRIM_INT__g_s_s_s,
583 PRIM_INT__f_s_s_s,
584 Q_PA,
585 aoq_PQ,
586 one_over_2pq,
587 9);
588
589
590 ostei_general_vrr_K(5, 0, 2, 0, 8,
591 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
592 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);
593
594
595 ostei_general_vrr_K(6, 0, 3, 0, 7,
596 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
597 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);
598
599
600 VRR_K_f_s_p_s(
601 PRIM_INT__f_s_p_s,
602 PRIM_INT__f_s_s_s,
603 PRIM_INT__d_s_s_s,
604 Q_PA,
605 aoq_PQ,
606 one_over_2pq,
607 9);
608
609
610 ostei_general_vrr_K(4, 0, 2, 0, 8,
611 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
612 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);
613
614
615 ostei_general_vrr_K(5, 0, 3, 0, 7,
616 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
617 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);
618
619
620 ostei_general_vrr_K(6, 0, 4, 0, 6,
621 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
622 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);
623
624
625
626 // Forming PRIM_INT__d_s_p_s[9 * 18];
627 for(n = 0; n < 9; ++n) // loop over orders of auxiliary function
628 {
629
630 PRIM_INT__d_s_p_s[n * 18 + 0] = SIMINT_MUL(Q_PA[0], PRIM_INT__d_s_s_s[n * 6 + 0]);
631 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]);
632 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]);
633
634 PRIM_INT__d_s_p_s[n * 18 + 1] = SIMINT_MUL(Q_PA[1], PRIM_INT__d_s_s_s[n * 6 + 0]);
635 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]);
636
637 PRIM_INT__d_s_p_s[n * 18 + 2] = SIMINT_MUL(Q_PA[2], PRIM_INT__d_s_s_s[n * 6 + 0]);
638 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]);
639
640 PRIM_INT__d_s_p_s[n * 18 + 3] = SIMINT_MUL(Q_PA[0], PRIM_INT__d_s_s_s[n * 6 + 1]);
641 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]);
642 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]);
643
644 PRIM_INT__d_s_p_s[n * 18 + 4] = SIMINT_MUL(Q_PA[1], PRIM_INT__d_s_s_s[n * 6 + 1]);
645 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]);
646 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]);
647
648 PRIM_INT__d_s_p_s[n * 18 + 5] = SIMINT_MUL(Q_PA[2], PRIM_INT__d_s_s_s[n * 6 + 1]);
649 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]);
650
651 PRIM_INT__d_s_p_s[n * 18 + 6] = SIMINT_MUL(Q_PA[0], PRIM_INT__d_s_s_s[n * 6 + 2]);
652 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]);
653 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]);
654
655 PRIM_INT__d_s_p_s[n * 18 + 7] = SIMINT_MUL(Q_PA[1], PRIM_INT__d_s_s_s[n * 6 + 2]);
656 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]);
657
658 PRIM_INT__d_s_p_s[n * 18 + 8] = SIMINT_MUL(Q_PA[2], PRIM_INT__d_s_s_s[n * 6 + 2]);
659 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]);
660 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]);
661
662 PRIM_INT__d_s_p_s[n * 18 + 9] = SIMINT_MUL(Q_PA[0], PRIM_INT__d_s_s_s[n * 6 + 3]);
663 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]);
664
665 PRIM_INT__d_s_p_s[n * 18 + 10] = SIMINT_MUL(Q_PA[1], PRIM_INT__d_s_s_s[n * 6 + 3]);
666 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]);
667 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]);
668
669 PRIM_INT__d_s_p_s[n * 18 + 11] = SIMINT_MUL(Q_PA[2], PRIM_INT__d_s_s_s[n * 6 + 3]);
670 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]);
671
672 PRIM_INT__d_s_p_s[n * 18 + 12] = SIMINT_MUL(Q_PA[0], PRIM_INT__d_s_s_s[n * 6 + 4]);
673 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]);
674
675 PRIM_INT__d_s_p_s[n * 18 + 13] = SIMINT_MUL(Q_PA[1], PRIM_INT__d_s_s_s[n * 6 + 4]);
676 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]);
677 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]);
678
679 PRIM_INT__d_s_p_s[n * 18 + 14] = SIMINT_MUL(Q_PA[2], PRIM_INT__d_s_s_s[n * 6 + 4]);
680 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]);
681 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]);
682
683 PRIM_INT__d_s_p_s[n * 18 + 15] = SIMINT_MUL(Q_PA[0], PRIM_INT__d_s_s_s[n * 6 + 5]);
684 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]);
685
686 PRIM_INT__d_s_p_s[n * 18 + 16] = SIMINT_MUL(Q_PA[1], PRIM_INT__d_s_s_s[n * 6 + 5]);
687 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]);
688
689 PRIM_INT__d_s_p_s[n * 18 + 17] = SIMINT_MUL(Q_PA[2], PRIM_INT__d_s_s_s[n * 6 + 5]);
690 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]);
691 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]);
692
693 }
694
695
696 VRR_K_f_s_d_s(
697 PRIM_INT__f_s_d_s,
698 PRIM_INT__f_s_p_s,
699 PRIM_INT__f_s_s_s,
700 PRIM_INT__d_s_p_s,
701 Q_PA,
702 a_over_q,
703 aoq_PQ,
704 one_over_2pq,
705 one_over_2q,
706 8);
707
708
709 ostei_general_vrr_K(4, 0, 3, 0, 7,
710 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
711 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);
712
713
714 ostei_general_vrr_K(5, 0, 4, 0, 6,
715 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
716 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);
717
718
719 ostei_general_vrr_K(6, 0, 5, 0, 5,
720 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
721 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);
722
723
724
725 // Forming PRIM_INT__p_s_p_s[9 * 9];
726 for(n = 0; n < 9; ++n) // loop over orders of auxiliary function
727 {
728
729 PRIM_INT__p_s_p_s[n * 9 + 0] = SIMINT_MUL(Q_PA[0], PRIM_INT__p_s_s_s[n * 3 + 0]);
730 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]);
731 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]);
732
733 PRIM_INT__p_s_p_s[n * 9 + 1] = SIMINT_MUL(Q_PA[1], PRIM_INT__p_s_s_s[n * 3 + 0]);
734 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]);
735
736 PRIM_INT__p_s_p_s[n * 9 + 2] = SIMINT_MUL(Q_PA[2], PRIM_INT__p_s_s_s[n * 3 + 0]);
737 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]);
738
739 PRIM_INT__p_s_p_s[n * 9 + 3] = SIMINT_MUL(Q_PA[0], PRIM_INT__p_s_s_s[n * 3 + 1]);
740 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]);
741
742 PRIM_INT__p_s_p_s[n * 9 + 4] = SIMINT_MUL(Q_PA[1], PRIM_INT__p_s_s_s[n * 3 + 1]);
743 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]);
744 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]);
745
746 PRIM_INT__p_s_p_s[n * 9 + 5] = SIMINT_MUL(Q_PA[2], PRIM_INT__p_s_s_s[n * 3 + 1]);
747 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]);
748
749 PRIM_INT__p_s_p_s[n * 9 + 6] = SIMINT_MUL(Q_PA[0], PRIM_INT__p_s_s_s[n * 3 + 2]);
750 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]);
751
752 PRIM_INT__p_s_p_s[n * 9 + 7] = SIMINT_MUL(Q_PA[1], PRIM_INT__p_s_s_s[n * 3 + 2]);
753 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]);
754
755 PRIM_INT__p_s_p_s[n * 9 + 8] = SIMINT_MUL(Q_PA[2], PRIM_INT__p_s_s_s[n * 3 + 2]);
756 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]);
757 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]);
758
759 }
760
761
762 VRR_K_d_s_d_s(
763 PRIM_INT__d_s_d_s,
764 PRIM_INT__d_s_p_s,
765 PRIM_INT__d_s_s_s,
766 PRIM_INT__p_s_p_s,
767 Q_PA,
768 a_over_q,
769 aoq_PQ,
770 one_over_2pq,
771 one_over_2q,
772 8);
773
774
775 ostei_general_vrr_K(3, 0, 3, 0, 7,
776 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
777 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);
778
779
780 ostei_general_vrr_K(4, 0, 4, 0, 6,
781 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
782 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);
783
784
785 ostei_general_vrr_K(5, 0, 5, 0, 5,
786 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
787 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);
788
789
790 ostei_general_vrr_K(6, 0, 6, 0, 4,
791 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
792 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);
793
794
795
796 // Forming PRIM_INT__s_s_p_s[9 * 3];
797 for(n = 0; n < 9; ++n) // loop over orders of auxiliary function
798 {
799
800 PRIM_INT__s_s_p_s[n * 3 + 0] = SIMINT_MUL(Q_PA[0], PRIM_INT__s_s_s_s[n * 1 + 0]);
801 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]);
802
803 PRIM_INT__s_s_p_s[n * 3 + 1] = SIMINT_MUL(Q_PA[1], PRIM_INT__s_s_s_s[n * 1 + 0]);
804 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]);
805
806 PRIM_INT__s_s_p_s[n * 3 + 2] = SIMINT_MUL(Q_PA[2], PRIM_INT__s_s_s_s[n * 1 + 0]);
807 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]);
808
809 }
810
811
812
813 // Forming PRIM_INT__p_s_d_s[8 * 18];
814 for(n = 0; n < 8; ++n) // loop over orders of auxiliary function
815 {
816
817 PRIM_INT__p_s_d_s[n * 18 + 0] = SIMINT_MUL(Q_PA[0], PRIM_INT__p_s_p_s[n * 9 + 0]);
818 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]);
819 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]);
820 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]);
821
822 PRIM_INT__p_s_d_s[n * 18 + 3] = SIMINT_MUL(Q_PA[1], PRIM_INT__p_s_p_s[n * 9 + 1]);
823 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]);
824 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]);
825
826 PRIM_INT__p_s_d_s[n * 18 + 5] = SIMINT_MUL(Q_PA[2], PRIM_INT__p_s_p_s[n * 9 + 2]);
827 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]);
828 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]);
829
830 PRIM_INT__p_s_d_s[n * 18 + 6] = SIMINT_MUL(Q_PA[0], PRIM_INT__p_s_p_s[n * 9 + 3]);
831 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]);
832 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]);
833
834 PRIM_INT__p_s_d_s[n * 18 + 9] = SIMINT_MUL(Q_PA[1], PRIM_INT__p_s_p_s[n * 9 + 4]);
835 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]);
836 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]);
837 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]);
838
839 PRIM_INT__p_s_d_s[n * 18 + 11] = SIMINT_MUL(Q_PA[2], PRIM_INT__p_s_p_s[n * 9 + 5]);
840 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]);
841 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]);
842
843 PRIM_INT__p_s_d_s[n * 18 + 12] = SIMINT_MUL(Q_PA[0], PRIM_INT__p_s_p_s[n * 9 + 6]);
844 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]);
845 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]);
846
847 PRIM_INT__p_s_d_s[n * 18 + 15] = SIMINT_MUL(Q_PA[1], PRIM_INT__p_s_p_s[n * 9 + 7]);
848 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]);
849 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]);
850
851 PRIM_INT__p_s_d_s[n * 18 + 17] = SIMINT_MUL(Q_PA[2], PRIM_INT__p_s_p_s[n * 9 + 8]);
852 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]);
853 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]);
854 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]);
855
856 }
857
858
859 VRR_K_d_s_f_s(
860 PRIM_INT__d_s_f_s,
861 PRIM_INT__d_s_d_s,
862 PRIM_INT__d_s_p_s,
863 PRIM_INT__p_s_d_s,
864 Q_PA,
865 a_over_q,
866 aoq_PQ,
867 one_over_2pq,
868 one_over_2q,
869 7);
870
871
872 ostei_general_vrr_K(3, 0, 4, 0, 6,
873 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
874 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);
875
876
877 ostei_general_vrr_K(4, 0, 5, 0, 5,
878 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
879 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);
880
881
882 ostei_general_vrr_K(5, 0, 6, 0, 4,
883 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
884 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);
885
886
887 ostei_general_vrr_K(6, 0, 7, 0, 3,
888 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
889 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);
890
891
892
893 // Forming PRIM_INT__s_s_d_s[8 * 6];
894 for(n = 0; n < 8; ++n) // loop over orders of auxiliary function
895 {
896
897 PRIM_INT__s_s_d_s[n * 6 + 0] = SIMINT_MUL(Q_PA[0], PRIM_INT__s_s_p_s[n * 3 + 0]);
898 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]);
899 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]);
900
901 PRIM_INT__s_s_d_s[n * 6 + 3] = SIMINT_MUL(Q_PA[1], PRIM_INT__s_s_p_s[n * 3 + 1]);
902 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]);
903 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]);
904
905 PRIM_INT__s_s_d_s[n * 6 + 5] = SIMINT_MUL(Q_PA[2], PRIM_INT__s_s_p_s[n * 3 + 2]);
906 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]);
907 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]);
908
909 }
910
911
912 VRR_K_p_s_f_s(
913 PRIM_INT__p_s_f_s,
914 PRIM_INT__p_s_d_s,
915 PRIM_INT__p_s_p_s,
916 PRIM_INT__s_s_d_s,
917 Q_PA,
918 a_over_q,
919 aoq_PQ,
920 one_over_2pq,
921 one_over_2q,
922 7);
923
924
925 ostei_general_vrr_K(2, 0, 4, 0, 6,
926 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
927 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);
928
929
930 ostei_general_vrr_K(3, 0, 5, 0, 5,
931 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
932 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);
933
934
935 ostei_general_vrr_K(4, 0, 6, 0, 4,
936 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
937 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);
938
939
940 ostei_general_vrr_K(5, 0, 7, 0, 3,
941 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
942 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);
943
944
945 ostei_general_vrr_K(6, 0, 8, 0, 2,
946 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
947 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);
948
949
950 ostei_general_vrr1_I(7, 14,
951 one_over_2p, a_over_p, aop_PQ, P_PA,
952 PRIM_INT__i_s_s_s, PRIM_INT__h_s_s_s, PRIM_INT__k_s_s_s);
953
954
955 ostei_general_vrr_K(7, 0, 1, 0, 9,
956 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
957 PRIM_INT__k_s_s_s, NULL, NULL, PRIM_INT__i_s_s_s, NULL, PRIM_INT__k_s_p_s);
958
959
960 ostei_general_vrr_K(7, 0, 2, 0, 8,
961 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
962 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);
963
964
965 ostei_general_vrr_K(7, 0, 3, 0, 7,
966 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
967 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);
968
969
970 ostei_general_vrr_K(7, 0, 4, 0, 6,
971 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
972 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);
973
974
975 ostei_general_vrr_K(7, 0, 5, 0, 5,
976 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
977 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);
978
979
980 ostei_general_vrr_K(7, 0, 6, 0, 4,
981 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
982 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);
983
984
985 ostei_general_vrr_K(7, 0, 7, 0, 3,
986 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
987 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);
988
989
990
991 // Forming PRIM_INT__s_s_f_s[7 * 10];
992 for(n = 0; n < 7; ++n) // loop over orders of auxiliary function
993 {
994
995 PRIM_INT__s_s_f_s[n * 10 + 0] = SIMINT_MUL(Q_PA[0], PRIM_INT__s_s_d_s[n * 6 + 0]);
996 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]);
997 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]);
998
999 PRIM_INT__s_s_f_s[n * 10 + 6] = SIMINT_MUL(Q_PA[1], PRIM_INT__s_s_d_s[n * 6 + 3]);
1000 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]);
1001 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]);
1002
1003 PRIM_INT__s_s_f_s[n * 10 + 9] = SIMINT_MUL(Q_PA[2], PRIM_INT__s_s_d_s[n * 6 + 5]);
1004 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]);
1005 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]);
1006
1007 }
1008
1009
1010 VRR_K_p_s_g_s(
1011 PRIM_INT__p_s_g_s,
1012 PRIM_INT__p_s_f_s,
1013 PRIM_INT__p_s_d_s,
1014 PRIM_INT__s_s_f_s,
1015 Q_PA,
1016 a_over_q,
1017 aoq_PQ,
1018 one_over_2pq,
1019 one_over_2q,
1020 6);
1021
1022
1023 ostei_general_vrr_K(2, 0, 5, 0, 5,
1024 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1025 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);
1026
1027
1028 ostei_general_vrr_K(3, 0, 6, 0, 4,
1029 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1030 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);
1031
1032
1033 ostei_general_vrr_K(4, 0, 7, 0, 3,
1034 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1035 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);
1036
1037
1038 ostei_general_vrr_K(5, 0, 8, 0, 2,
1039 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1040 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);
1041
1042
1043 ostei_general_vrr_K(6, 0, 9, 0, 1,
1044 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1045 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);
1046
1047
1048 ostei_general_vrr_K(7, 0, 8, 0, 2,
1049 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1050 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);
1051
1052
1053 ostei_general_vrr1_I(8, 13,
1054 one_over_2p, a_over_p, aop_PQ, P_PA,
1055 PRIM_INT__k_s_s_s, PRIM_INT__i_s_s_s, PRIM_INT__l_s_s_s);
1056
1057
1058 ostei_general_vrr_K(8, 0, 1, 0, 9,
1059 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1060 PRIM_INT__l_s_s_s, NULL, NULL, PRIM_INT__k_s_s_s, NULL, PRIM_INT__l_s_p_s);
1061
1062
1063 ostei_general_vrr_K(8, 0, 2, 0, 8,
1064 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1065 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);
1066
1067
1068 ostei_general_vrr_K(8, 0, 3, 0, 7,
1069 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1070 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);
1071
1072
1073 ostei_general_vrr_K(8, 0, 4, 0, 6,
1074 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1075 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);
1076
1077
1078 ostei_general_vrr_K(8, 0, 5, 0, 5,
1079 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1080 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);
1081
1082
1083 ostei_general_vrr_K(8, 0, 6, 0, 4,
1084 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1085 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);
1086
1087
1088 ostei_general_vrr_K(8, 0, 7, 0, 3,
1089 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1090 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);
1091
1092
1093 ostei_general_vrr_K(7, 0, 9, 0, 1,
1094 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1095 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);
1096
1097
1098 ostei_general_vrr_K(8, 0, 8, 0, 2,
1099 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1100 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);
1101
1102
1103 ostei_general_vrr1_I(9, 12,
1104 one_over_2p, a_over_p, aop_PQ, P_PA,
1105 PRIM_INT__l_s_s_s, PRIM_INT__k_s_s_s, PRIM_INT__m_s_s_s);
1106
1107
1108 ostei_general_vrr_K(9, 0, 1, 0, 9,
1109 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1110 PRIM_INT__m_s_s_s, NULL, NULL, PRIM_INT__l_s_s_s, NULL, PRIM_INT__m_s_p_s);
1111
1112
1113 ostei_general_vrr_K(9, 0, 2, 0, 8,
1114 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1115 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);
1116
1117
1118 ostei_general_vrr_K(9, 0, 3, 0, 7,
1119 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1120 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);
1121
1122
1123 ostei_general_vrr_K(9, 0, 4, 0, 6,
1124 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1125 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);
1126
1127
1128 ostei_general_vrr_K(9, 0, 5, 0, 5,
1129 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1130 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);
1131
1132
1133 ostei_general_vrr_K(9, 0, 6, 0, 4,
1134 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1135 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);
1136
1137
1138 ostei_general_vrr_K(9, 0, 7, 0, 3,
1139 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1140 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);
1141
1142
1143 ostei_general_vrr_K(8, 0, 9, 0, 1,
1144 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1145 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);
1146
1147
1148 ostei_general_vrr_K(9, 0, 8, 0, 2,
1149 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1150 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);
1151
1152
1153 ostei_general_vrr1_I(10, 11,
1154 one_over_2p, a_over_p, aop_PQ, P_PA,
1155 PRIM_INT__m_s_s_s, PRIM_INT__l_s_s_s, PRIM_INT__n_s_s_s);
1156
1157
1158 ostei_general_vrr_K(10, 0, 1, 0, 9,
1159 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1160 PRIM_INT__n_s_s_s, NULL, NULL, PRIM_INT__m_s_s_s, NULL, PRIM_INT__n_s_p_s);
1161
1162
1163 ostei_general_vrr_K(10, 0, 2, 0, 8,
1164 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1165 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);
1166
1167
1168 ostei_general_vrr_K(10, 0, 3, 0, 7,
1169 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1170 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);
1171
1172
1173 ostei_general_vrr_K(10, 0, 4, 0, 6,
1174 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1175 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);
1176
1177
1178 ostei_general_vrr_K(10, 0, 5, 0, 5,
1179 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1180 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);
1181
1182
1183 ostei_general_vrr_K(10, 0, 6, 0, 4,
1184 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1185 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);
1186
1187
1188 ostei_general_vrr_K(10, 0, 7, 0, 3,
1189 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1190 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);
1191
1192
1193 ostei_general_vrr_K(9, 0, 9, 0, 1,
1194 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1195 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);
1196
1197
1198 ostei_general_vrr_K(10, 0, 8, 0, 2,
1199 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1200 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);
1201
1202
1203 ostei_general_vrr1_I(11, 10,
1204 one_over_2p, a_over_p, aop_PQ, P_PA,
1205 PRIM_INT__n_s_s_s, PRIM_INT__m_s_s_s, PRIM_INT__o_s_s_s);
1206
1207
1208 ostei_general_vrr_K(11, 0, 1, 0, 9,
1209 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1210 PRIM_INT__o_s_s_s, NULL, NULL, PRIM_INT__n_s_s_s, NULL, PRIM_INT__o_s_p_s);
1211
1212
1213 ostei_general_vrr_K(11, 0, 2, 0, 8,
1214 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1215 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);
1216
1217
1218 ostei_general_vrr_K(11, 0, 3, 0, 7,
1219 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1220 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);
1221
1222
1223 ostei_general_vrr_K(11, 0, 4, 0, 6,
1224 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1225 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);
1226
1227
1228 ostei_general_vrr_K(11, 0, 5, 0, 5,
1229 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1230 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);
1231
1232
1233 ostei_general_vrr_K(11, 0, 6, 0, 4,
1234 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1235 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);
1236
1237
1238 ostei_general_vrr_K(11, 0, 7, 0, 3,
1239 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1240 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);
1241
1242
1243 ostei_general_vrr_K(10, 0, 9, 0, 1,
1244 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1245 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);
1246
1247
1248 ostei_general_vrr_K(11, 0, 8, 0, 2,
1249 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1250 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);
1251
1252
1253 ostei_general_vrr_K(11, 0, 9, 0, 1,
1254 one_over_2q, a_over_q, one_over_2pq, aoq_PQ, Q_PA,
1255 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);
1256
1257
1258
1259
1260 ////////////////////////////////////
1261 // Accumulate contracted integrals
1262 ////////////////////////////////////
1263 if(lastoffset == 0)
1264 {
1265 contract_all(1008, PRIM_INT__i_s_k_s, PRIM_PTR_INT__i_s_k_s);
1266 contract_all(1260, PRIM_INT__i_s_l_s, PRIM_PTR_INT__i_s_l_s);
1267 contract_all(1540, PRIM_INT__i_s_m_s, PRIM_PTR_INT__i_s_m_s);
1268 contract_all(1296, PRIM_INT__k_s_k_s, PRIM_PTR_INT__k_s_k_s);
1269 contract_all(1620, PRIM_INT__k_s_l_s, PRIM_PTR_INT__k_s_l_s);
1270 contract_all(1980, PRIM_INT__k_s_m_s, PRIM_PTR_INT__k_s_m_s);
1271 contract_all(1620, PRIM_INT__l_s_k_s, PRIM_PTR_INT__l_s_k_s);
1272 contract_all(2025, PRIM_INT__l_s_l_s, PRIM_PTR_INT__l_s_l_s);
1273 contract_all(2475, PRIM_INT__l_s_m_s, PRIM_PTR_INT__l_s_m_s);
1274 contract_all(1980, PRIM_INT__m_s_k_s, PRIM_PTR_INT__m_s_k_s);
1275 contract_all(2475, PRIM_INT__m_s_l_s, PRIM_PTR_INT__m_s_l_s);
1276 contract_all(3025, PRIM_INT__m_s_m_s, PRIM_PTR_INT__m_s_m_s);
1277 contract_all(2376, PRIM_INT__n_s_k_s, PRIM_PTR_INT__n_s_k_s);
1278 contract_all(2970, PRIM_INT__n_s_l_s, PRIM_PTR_INT__n_s_l_s);
1279 contract_all(3630, PRIM_INT__n_s_m_s, PRIM_PTR_INT__n_s_m_s);
1280 contract_all(2808, PRIM_INT__o_s_k_s, PRIM_PTR_INT__o_s_k_s);
1281 contract_all(3510, PRIM_INT__o_s_l_s, PRIM_PTR_INT__o_s_l_s);
1282 contract_all(4290, PRIM_INT__o_s_m_s, PRIM_PTR_INT__o_s_m_s);
1283 }
1284 else
1285 {
1286 contract(1008, shelloffsets, PRIM_INT__i_s_k_s, PRIM_PTR_INT__i_s_k_s);
1287 contract(1260, shelloffsets, PRIM_INT__i_s_l_s, PRIM_PTR_INT__i_s_l_s);
1288 contract(1540, shelloffsets, PRIM_INT__i_s_m_s, PRIM_PTR_INT__i_s_m_s);
1289 contract(1296, shelloffsets, PRIM_INT__k_s_k_s, PRIM_PTR_INT__k_s_k_s);
1290 contract(1620, shelloffsets, PRIM_INT__k_s_l_s, PRIM_PTR_INT__k_s_l_s);
1291 contract(1980, shelloffsets, PRIM_INT__k_s_m_s, PRIM_PTR_INT__k_s_m_s);
1292 contract(1620, shelloffsets, PRIM_INT__l_s_k_s, PRIM_PTR_INT__l_s_k_s);
1293 contract(2025, shelloffsets, PRIM_INT__l_s_l_s, PRIM_PTR_INT__l_s_l_s);
1294 contract(2475, shelloffsets, PRIM_INT__l_s_m_s, PRIM_PTR_INT__l_s_m_s);
1295 contract(1980, shelloffsets, PRIM_INT__m_s_k_s, PRIM_PTR_INT__m_s_k_s);
1296 contract(2475, shelloffsets, PRIM_INT__m_s_l_s, PRIM_PTR_INT__m_s_l_s);
1297 contract(3025, shelloffsets, PRIM_INT__m_s_m_s, PRIM_PTR_INT__m_s_m_s);
1298 contract(2376, shelloffsets, PRIM_INT__n_s_k_s, PRIM_PTR_INT__n_s_k_s);
1299 contract(2970, shelloffsets, PRIM_INT__n_s_l_s, PRIM_PTR_INT__n_s_l_s);
1300 contract(3630, shelloffsets, PRIM_INT__n_s_m_s, PRIM_PTR_INT__n_s_m_s);
1301 contract(2808, shelloffsets, PRIM_INT__o_s_k_s, PRIM_PTR_INT__o_s_k_s);
1302 contract(3510, shelloffsets, PRIM_INT__o_s_l_s, PRIM_PTR_INT__o_s_l_s);
1303 contract(4290, shelloffsets, PRIM_INT__o_s_m_s, PRIM_PTR_INT__o_s_m_s);
1304 PRIM_PTR_INT__i_s_k_s += lastoffset*1008;
1305 PRIM_PTR_INT__i_s_l_s += lastoffset*1260;
1306 PRIM_PTR_INT__i_s_m_s += lastoffset*1540;
1307 PRIM_PTR_INT__k_s_k_s += lastoffset*1296;
1308 PRIM_PTR_INT__k_s_l_s += lastoffset*1620;
1309 PRIM_PTR_INT__k_s_m_s += lastoffset*1980;
1310 PRIM_PTR_INT__l_s_k_s += lastoffset*1620;
1311 PRIM_PTR_INT__l_s_l_s += lastoffset*2025;
1312 PRIM_PTR_INT__l_s_m_s += lastoffset*2475;
1313 PRIM_PTR_INT__m_s_k_s += lastoffset*1980;
1314 PRIM_PTR_INT__m_s_l_s += lastoffset*2475;
1315 PRIM_PTR_INT__m_s_m_s += lastoffset*3025;
1316 PRIM_PTR_INT__n_s_k_s += lastoffset*2376;
1317 PRIM_PTR_INT__n_s_l_s += lastoffset*2970;
1318 PRIM_PTR_INT__n_s_m_s += lastoffset*3630;
1319 PRIM_PTR_INT__o_s_k_s += lastoffset*2808;
1320 PRIM_PTR_INT__o_s_l_s += lastoffset*3510;
1321 PRIM_PTR_INT__o_s_m_s += lastoffset*4290;
1322 }
1323
1324 } // close loop over j
1325 } // close loop over i
1326
1327 //Advance to the next batch
1328 jstart = SIMINT_SIMD_ROUND(jend);
1329
1330 //////////////////////////////////////////////
1331 // Contracted integrals: Horizontal recurrance
1332 //////////////////////////////////////////////
1333
1334
1335 const double hAB[3] = { P.AB_x[ab], P.AB_y[ab], P.AB_z[ab] };
1336
1337
1338 for(abcd = 0; abcd < nshellbatch; ++abcd, ++real_abcd)
1339 {
1340 const double hCD[3] = { Q.AB_x[cd+abcd], Q.AB_y[cd+abcd], Q.AB_z[cd+abcd] };
1341
1342 // set up HRR pointers
1343 double const * restrict HRR_INT__i_s_k_s = INT__i_s_k_s + abcd * 1008;
1344 double const * restrict HRR_INT__i_s_l_s = INT__i_s_l_s + abcd * 1260;
1345 double const * restrict HRR_INT__i_s_m_s = INT__i_s_m_s + abcd * 1540;
1346 double const * restrict HRR_INT__k_s_k_s = INT__k_s_k_s + abcd * 1296;
1347 double const * restrict HRR_INT__k_s_l_s = INT__k_s_l_s + abcd * 1620;
1348 double const * restrict HRR_INT__k_s_m_s = INT__k_s_m_s + abcd * 1980;
1349 double const * restrict HRR_INT__l_s_k_s = INT__l_s_k_s + abcd * 1620;
1350 double const * restrict HRR_INT__l_s_l_s = INT__l_s_l_s + abcd * 2025;
1351 double const * restrict HRR_INT__l_s_m_s = INT__l_s_m_s + abcd * 2475;
1352 double const * restrict HRR_INT__m_s_k_s = INT__m_s_k_s + abcd * 1980;
1353 double const * restrict HRR_INT__m_s_l_s = INT__m_s_l_s + abcd * 2475;
1354 double const * restrict HRR_INT__m_s_m_s = INT__m_s_m_s + abcd * 3025;
1355 double const * restrict HRR_INT__n_s_k_s = INT__n_s_k_s + abcd * 2376;
1356 double const * restrict HRR_INT__n_s_l_s = INT__n_s_l_s + abcd * 2970;
1357 double const * restrict HRR_INT__n_s_m_s = INT__n_s_m_s + abcd * 3630;
1358 double const * restrict HRR_INT__o_s_k_s = INT__o_s_k_s + abcd * 2808;
1359 double const * restrict HRR_INT__o_s_l_s = INT__o_s_l_s + abcd * 3510;
1360 double const * restrict HRR_INT__o_s_m_s = INT__o_s_m_s + abcd * 4290;
1361 double * restrict HRR_INT__i_h_k_d = INT__i_h_k_d + real_abcd * 127008;
1362
1363 // form INT__i_p_k_s
1364 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);
1365
1366 // form INT__i_p_l_s
1367 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);
1368
1369 // form INT__i_p_m_s
1370 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);
1371
1372 // form INT__k_p_k_s
1373 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);
1374
1375 // form INT__k_p_l_s
1376 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);
1377
1378 // form INT__k_p_m_s
1379 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);
1380
1381 // form INT__l_p_k_s
1382 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);
1383
1384 // form INT__l_p_l_s
1385 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);
1386
1387 // form INT__l_p_m_s
1388 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);
1389
1390 // form INT__m_p_k_s
1391 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);
1392
1393 // form INT__m_p_l_s
1394 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);
1395
1396 // form INT__m_p_m_s
1397 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);
1398
1399 // form INT__n_p_k_s
1400 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);
1401
1402 // form INT__n_p_l_s
1403 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);
1404
1405 // form INT__n_p_m_s
1406 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);
1407
1408 // form INT__i_d_k_s
1409 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);
1410
1411 // form INT__i_d_l_s
1412 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);
1413
1414 // form INT__i_d_m_s
1415 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);
1416
1417 // form INT__k_d_k_s
1418 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);
1419
1420 // form INT__k_d_l_s
1421 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);
1422
1423 // form INT__k_d_m_s
1424 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);
1425
1426 // form INT__l_d_k_s
1427 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);
1428
1429 // form INT__l_d_l_s
1430 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);
1431
1432 // form INT__l_d_m_s
1433 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);
1434
1435 // form INT__m_d_k_s
1436 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);
1437
1438 // form INT__m_d_l_s
1439 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);
1440
1441 // form INT__m_d_m_s
1442 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);
1443
1444 // form INT__i_f_k_s
1445 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);
1446
1447 // form INT__i_f_l_s
1448 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);
1449
1450 // form INT__i_f_m_s
1451 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);
1452
1453 // form INT__k_f_k_s
1454 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);
1455
1456 // form INT__k_f_l_s
1457 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);
1458
1459 // form INT__k_f_m_s
1460 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);
1461
1462 // form INT__l_f_k_s
1463 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);
1464
1465 // form INT__l_f_l_s
1466 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);
1467
1468 // form INT__l_f_m_s
1469 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);
1470
1471 // form INT__i_g_k_s
1472 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);
1473
1474 // form INT__i_g_l_s
1475 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);
1476
1477 // form INT__i_g_m_s
1478 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);
1479
1480 // form INT__k_g_k_s
1481 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);
1482
1483 // form INT__k_g_l_s
1484 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);
1485
1486 // form INT__k_g_m_s
1487 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);
1488
1489 // form INT__i_h_k_s
1490 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);
1491
1492 // form INT__i_h_l_s
1493 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);
1494
1495 // form INT__i_h_m_s
1496 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);
1497
1498 // form INT__i_h_k_p
1499 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);
1500
1501 // form INT__i_h_l_p
1502 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);
1503
1504 // form INT__i_h_k_d
1505 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);
1506
1507
1508 } // close HRR loop
1509
1510
1511 } // close loop cdbatch
1512
1513 istart = iend;
1514 } // close loop over ab
1515
1516 return P.nshell12_clip * Q.nshell12_clip;
1517 }
1518
ostei_h_i_k_d(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_d)1519 int ostei_h_i_k_d(struct simint_multi_shellpair const P,
1520 struct simint_multi_shellpair const Q,
1521 double screen_tol,
1522 double * const restrict work,
1523 double * const restrict INT__h_i_k_d)
1524 {
1525 double P_AB[3*P.nshell12];
1526 struct simint_multi_shellpair P_tmp = P;
1527 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z;
1528 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z;
1529 P_tmp.AB_x = P_AB;
1530 P_tmp.AB_y = P_AB + P.nshell12;
1531 P_tmp.AB_z = P_AB + 2*P.nshell12;
1532
1533 for(int i = 0; i < P.nshell12; i++)
1534 {
1535 P_tmp.AB_x[i] = -P.AB_x[i];
1536 P_tmp.AB_y[i] = -P.AB_y[i];
1537 P_tmp.AB_z[i] = -P.AB_z[i];
1538 }
1539
1540 int ret = ostei_i_h_k_d(P_tmp, Q, screen_tol, work, INT__h_i_k_d);
1541 double buffer[127008] SIMINT_ALIGN_ARRAY_DBL;
1542
1543 for(int q = 0; q < ret; q++)
1544 {
1545 int idx = 0;
1546 for(int a = 0; a < 21; ++a)
1547 for(int b = 0; b < 28; ++b)
1548 for(int c = 0; c < 36; ++c)
1549 for(int d = 0; d < 6; ++d)
1550 buffer[idx++] = INT__h_i_k_d[q*127008+b*4536+a*216+c*6+d];
1551
1552 memcpy(INT__h_i_k_d+q*127008, buffer, 127008*sizeof(double));
1553 }
1554
1555 return ret;
1556 }
1557
ostei_i_h_d_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_d_k)1558 int ostei_i_h_d_k(struct simint_multi_shellpair const P,
1559 struct simint_multi_shellpair const Q,
1560 double screen_tol,
1561 double * const restrict work,
1562 double * const restrict INT__i_h_d_k)
1563 {
1564 double Q_AB[3*Q.nshell12];
1565 struct simint_multi_shellpair Q_tmp = Q;
1566 Q_tmp.PA_x = Q.PB_x; Q_tmp.PA_y = Q.PB_y; Q_tmp.PA_z = Q.PB_z;
1567 Q_tmp.PB_x = Q.PA_x; Q_tmp.PB_y = Q.PA_y; Q_tmp.PB_z = Q.PA_z;
1568 Q_tmp.AB_x = Q_AB;
1569 Q_tmp.AB_y = Q_AB + Q.nshell12;
1570 Q_tmp.AB_z = Q_AB + 2*Q.nshell12;
1571
1572 for(int i = 0; i < Q.nshell12; i++)
1573 {
1574 Q_tmp.AB_x[i] = -Q.AB_x[i];
1575 Q_tmp.AB_y[i] = -Q.AB_y[i];
1576 Q_tmp.AB_z[i] = -Q.AB_z[i];
1577 }
1578
1579 int ret = ostei_i_h_k_d(P, Q_tmp, screen_tol, work, INT__i_h_d_k);
1580 double buffer[127008] SIMINT_ALIGN_ARRAY_DBL;
1581
1582 for(int q = 0; q < ret; q++)
1583 {
1584 int idx = 0;
1585 for(int a = 0; a < 28; ++a)
1586 for(int b = 0; b < 21; ++b)
1587 for(int c = 0; c < 6; ++c)
1588 for(int d = 0; d < 36; ++d)
1589 buffer[idx++] = INT__i_h_d_k[q*127008+a*4536+b*216+d*6+c];
1590
1591 memcpy(INT__i_h_d_k+q*127008, buffer, 127008*sizeof(double));
1592 }
1593
1594 return ret;
1595 }
1596
ostei_h_i_d_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_d_k)1597 int ostei_h_i_d_k(struct simint_multi_shellpair const P,
1598 struct simint_multi_shellpair const Q,
1599 double screen_tol,
1600 double * const restrict work,
1601 double * const restrict INT__h_i_d_k)
1602 {
1603 double P_AB[3*P.nshell12];
1604 struct simint_multi_shellpair P_tmp = P;
1605 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z;
1606 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z;
1607 P_tmp.AB_x = P_AB;
1608 P_tmp.AB_y = P_AB + P.nshell12;
1609 P_tmp.AB_z = P_AB + 2*P.nshell12;
1610
1611 for(int i = 0; i < P.nshell12; i++)
1612 {
1613 P_tmp.AB_x[i] = -P.AB_x[i];
1614 P_tmp.AB_y[i] = -P.AB_y[i];
1615 P_tmp.AB_z[i] = -P.AB_z[i];
1616 }
1617
1618 double Q_AB[3*Q.nshell12];
1619 struct simint_multi_shellpair Q_tmp = Q;
1620 Q_tmp.PA_x = Q.PB_x; Q_tmp.PA_y = Q.PB_y; Q_tmp.PA_z = Q.PB_z;
1621 Q_tmp.PB_x = Q.PA_x; Q_tmp.PB_y = Q.PA_y; Q_tmp.PB_z = Q.PA_z;
1622 Q_tmp.AB_x = Q_AB;
1623 Q_tmp.AB_y = Q_AB + Q.nshell12;
1624 Q_tmp.AB_z = Q_AB + 2*Q.nshell12;
1625
1626 for(int i = 0; i < Q.nshell12; i++)
1627 {
1628 Q_tmp.AB_x[i] = -Q.AB_x[i];
1629 Q_tmp.AB_y[i] = -Q.AB_y[i];
1630 Q_tmp.AB_z[i] = -Q.AB_z[i];
1631 }
1632
1633 int ret = ostei_i_h_k_d(P_tmp, Q_tmp, screen_tol, work, INT__h_i_d_k);
1634 double buffer[127008] SIMINT_ALIGN_ARRAY_DBL;
1635
1636 for(int q = 0; q < ret; q++)
1637 {
1638 int idx = 0;
1639 for(int a = 0; a < 21; ++a)
1640 for(int b = 0; b < 28; ++b)
1641 for(int c = 0; c < 6; ++c)
1642 for(int d = 0; d < 36; ++d)
1643 buffer[idx++] = INT__h_i_d_k[q*127008+b*4536+a*216+d*6+c];
1644
1645 memcpy(INT__h_i_d_k+q*127008, buffer, 127008*sizeof(double));
1646 }
1647
1648 return ret;
1649 }
1650
1651