/dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
H A D | gga_c_acggap.c | 10069 t7951 = t619 * t812; in func_pol() 10070 t7953 = t1278 * t7951 * t451; in func_pol() 10073 t7963 = t7951 * t4001; in func_pol() 10562 t9024 = t7951 * t5373; in func_pol() 10673 t9364 = t1278 * t7951 * t537; in func_pol() 10674 t9365 = t7951 * t8999; in func_pol() 10858 t9736 = t7951 * t9386; in func_pol() 11235 t10494 = t1278 * t7951 * t601; in func_pol() 11237 t10496 = t7951 * t10495; in func_pol() 11464 t10977 = t7951 * t10976; in func_pol() [all …]
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H A D | gga_c_pw91.c | 2203 double t7950, t7951, t7952, t7953, t7954, t7955, t7967, t7968; in func_pol() local 6450 t7951 = 0.34366858576436911004e1 * t2287; in func_pol() 6454 …60824916e-1 * t2408 + 0.20675905147922744397e-1 * t2816 + t7949 - t7950 - t7951 + t7952 + t7953 + … in func_pol() 6993 …291413087447e-1 * t3096 - t4414 + t9757 - t9758 + t2817 + t7949 - t7950 - t7951 + t7952 + t7953 + … in func_pol() 7448 …v4rho4[2] = t7952 + t7953 + t7954 - t7950 - t7951 - t7932 + t7933 - t7934 + t7929 + t7873 + 0.8e1 … in func_pol() 7747 …0.72e2 * t3099 - t9757 - t9758 + t4622 - 0.23260393291413087446e-1 * t4184 + t7949 - t7950 - t7951; in func_pol() 7902 …t14223 = -t7950 - t7951 + t7952 + t7953 + t7954 - 0.21973866044103791930e-2 * t3801 + t7 * (t14213… in func_pol()
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H A D | gga_xc_b97.c | 2021 double t7934, t7935, t7936, t7937, t7938, t7939, t7940, t7951; in func_pol() local 6097 t7951 = t2421 * t1049; in func_pol() 6145 …t8068 = t7547 + t7951 - t7952 + t8042 - t8046 - t8050 - t8054 + t8056 + t8058 - t8061 + t8064 + t8… in func_pol() 8462 …t22026 = -t7544 + t21073 + t21411 + t21412 + t21413 + t21414 + t21416 + t21417 + t7951 - t21418 - … in func_pol() 8532 …t22876 = t21073 + t2 * (t22579 + t22666 + t22703 + t22861) + 0.3e1 * t7951 - t7739 / 0.16e2 + 0.3e… in func_pol()
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H A D | gga_c_zvpbeint.c | 2625 double t7951, t7954, t7955, t7956, t7958, t7966, t7976, t7978; in func_pol() local 7438 t7951 = t7260 * t977; in func_pol() 7443 …t7966 = -0.89e2 / 0.72e2 * t7946 - t7949 / 0.64e2 + t7951 / 0.64e2 + t7955 - 0.7e1 / 0.192e3 * t79… in func_pol() 8005 …0626 / 0.16e2 - 0.11e2 / 0.64e2 * t980 * t981 * t10614 - t7949 / 0.96e2 + t7951 / 0.32e2 + t7954 /… in func_pol() 8216 …t12196 = 0.3e1 / 0.16e2 * t10736 + 0.3e1 / 0.64e2 * t7951 + t7955 - 0.7e1 / 0.64e2 * t7956 + t1076… in func_pol() 8269 …92e3 - 0.89e2 / 0.18e2 * t7946 - 0.3e1 / 0.64e2 * t980 * t2694 * t12448 + t7951 / 0.16e2 - 0.7e1 /… in func_pol()
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H A D | gga_x_sfat.c | 3252 double t7891, t7910, t7915, t7922, t7930, t7939, t7951, t7955; in func_pol() local 6082 t7951 = t349 * t115 * t7930; in func_pol() 6090 …t7997 = -0.224e3 / 0.729e3 * t56 * t21 * t132 * t1020 - 0.4e1 / 0.9e1 * t201 * t7951 - 0.32e2 / 0.… in func_pol() 6151 …0.33510321638291127877e2 * t87 * t7955 - 0.12566370614359172954e2 * t87 * t7951 - 0.86878611654828… in func_pol()
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H A D | gga_c_pbe_vwn.c | 2186 double t7950, t7951, t7953, t7954, t7955, t7956, t7958, t7960; in func_pol() local 5549 …t7951 = t5635 + t7891 + t5642 + t7892 - t7894 - t7895 + t5648 - t5652 + t5661 - t5666 - t7896 + t7… in func_pol() 5562 … * t128 * t144 * t7791 - (t7815 + t7827 + t7836 + t7845 + t7864 + t7889 + t7951 + t7966) * t126 * … in func_pol()
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H A D | gga_c_q2d.c | 4163 double t7944, t7947, t7948, t7951, t7952, t7955, t7958, t7961; in func_pol() local 10217 t7951 = t422 * t2423; in func_pol() 10218 t7952 = t7951 * t1163; in func_pol() 10843 t9005 = t7951 * t1753; in func_pol() 15996 …615598386e1 * t2437 * t7947 * t15198 + 0.13010442282307799193e1 * t2437 * t7951 * t4284 - 0.780626… in func_pol() 16062 …025997310e0 * t2437 * t2438 * t15146 + 0.13010442282307799193e1 * t2437 * t7951 * t4289 + 0.260208… in func_pol() 16929 …736281882051994620e0 * t7926 * t9005 + 0.86736281882051994620e0 * t2437 * t7951 * t5436 + 0.867362… in func_pol() 17704 …24 * t2161 + 0.43368140941025997310e0 * t2437 * t7951 * t6461 + 0.43368140941025997310e0 * t2437 *… in func_pol() 19622 …- 0.74374658418102021640e-3 * t39718 + 0.11423947533020470523e1 * t3233 * t7951 * t2883 - 0.347081… in func_pol()
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H A D | gga_c_regtpss.c | 2642 double t7951, t7953, t7954, t7955, t7962, t7963, t7964, t7965; in func_pol() local 6809 t7951 = 0.35089341735807877242e1 * t2750; in func_pol() 6810 …8e2 * t3351 - 0.9e1 * t3354 - t2592 + 0.59255020495841404221e-1 * t2747 - t7951 + 0.21973736767207… in func_pol() 8066 …t13559 = t4316 - t7951 - 0.3e1 * t3479 - 0.6e1 * t3481 + t7 * (-t12417 + t12201 + t9370 + t9394 + … in func_pol()
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H A D | gga_c_optc.c | 2626 double t7945, t7946, t7947, t7950, t7951, t7953, t7954, t7956; in func_pol() local 7898 t7951 = t3023 * t7950; in func_pol() 7922 …t8026 = -t5377 + t7940 + t7941 - t5387 + t7944 + t7947 * t3026 + t3021 * t7951 - t7956 + t3021 * t… in func_pol() 13263 t24337 = t7943 * t7951; in func_pol() 13685 t25703 = t7954 * t7951; in func_pol() 13747 …2 + 0.3e1 / 0.2e1 * t3021 * t3023 * t8016 * t650 * t192 + 0.3e1 * t7947 * t7951 + 0.3e1 / 0.2e1 * … in func_pol() 15080 … * t32485 + 0.2e1 * t3018 * t2771 * t99 * t101 * t3026 + 0.2e1 * t11539 * t7951 + t32495 - t32497 … in func_pol() 18825 t54580 = t4637 * t7951; in func_pol()
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H A D | gga_c_ft97.c | 6234 double t7947, t7948, t7949, t7951, t7952, t7953, t7954, t7956; in func_pol() local 14316 t7951 = t1570 * t363; in func_pol() 14317 t7952 = t7951 * t1580; in func_pol() 26605 t37245 = t7951 * t8252; in func_pol() 26640 t37358 = t7951 * t7960; in func_pol() 27019 …0.9e1 * t1901 * t38866 * t1880 * t1643 - 0.8e1 / 0.3e1 * t1901 * t10983 * t7951 * t8257 + 0.4e1 * … in func_pol() 27163 …1 * t446 * t574 * t605 * t2075 * t2152 - 0.8e1 / 0.3e1 * t1901 * t12741 * t7951 * t9208 - 0.16e2 /… in func_pol() 27164 t39708 = t7951 * t9229; in func_pol() 28514 t45771 = t3051 * t378 * t7951; in func_pol() 28855 …t3130 * t447 * t488 * t358 * t492 + 0.4e1 / 0.3e1 * t3130 * t447 * t110 * t7951 - 0.4e1 / 0.9e1 * … in func_pol() [all …]
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/dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
H A D | mgga_x_mggac.c | 33596 t7951 = t302 * t5048; in func_pol() 33600 t7955 = t7951 * t7954; in func_pol() 35385 t10424 = t7951 * t10331; in func_pol() 37314 t12958 = t7951 * t12393; in func_pol() 37315 t12959 = t7951 * t12539; in func_pol() 38423 t14297 = t7951 * t14296; in func_pol() 38425 t14299 = t7951 * t14298; in func_pol() 38433 t14307 = t7951 * t14306; in func_pol() 38438 t14313 = t7951 * t14312; in func_pol() 40207 t16643 = t7951 * t16642; in func_pol() [all …]
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H A D | mgga_x_mbeef.c | 282 double t7940, t7946, t7951, t7956, t7961, t7964, t7966, t7969; in func_unpol() local 3680 t7951 = t827 * t1414; in func_unpol() 5503 t16029 = t7951 * t12092; in func_unpol() 5722 t16852 = t7951 * t12391; in func_unpol() 28482 double t7949, t7951, t7956, t7965, t7967, t7969, t7971, t7973; in func_pol() local 33448 …t7951 = 0.3125e4 / 0.1944e4 * t7930 - 0.25e2 / 0.9e1 * t7934 - 0.25e2 / 0.288e3 * t7938 + 0.9e1 * … in func_pol() 33553 …* t288 * t8119 + 0.280678872e-1 * t301 * t7951 - 0.1338087942e-7 * t1818 * t1813 - 0.879090772e-2 … in func_pol() 37605 … * t23614 - 0.67207403218725000000e-2 * t23616 + 0.280678872e-1 * t1216 * t7951 - 0.27703053009259… in func_pol() 37714 …t24919 = -0.879090772e-2 * t991 * t7951 + 0.822139896e-3 * t8000 * t1071 + 0.48293717777777777778e… in func_pol() 39458 …t421 * t32075 - 0.565485306e-1 * t1789 * t7951 + 0.631891628e-2 * t31883 * t390 - 0.829574040e-6 *… in func_pol() [all …]
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H A D | mgga_x_mbeefvdw.c | 11947 t7952 = t683 * t7951; in func_ferr() 11967 t8005 = t677 * t7951; in func_ferr() 11985 t8051 = t742 * t7951; in func_ferr() 11991 t8062 = t687 * t7951; in func_ferr() 15407 t24214 = t3186 * t7951; in func_ferr() 15528 t24465 = t3303 * t7951; in func_ferr() 15537 t24482 = t3320 * t7951; in func_ferr() 15652 t25017 = t3151 * t7951; in func_ferr() 21673 t7951 = t1851 * t515; in func_pol() 21674 t7952 = t7951 * t2585; in func_pol() [all …]
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H A D | mgga_x_m11.c | 3175 double t7932, t7935, t7938, t7943, t7946, t7951, t7956, t7961; in func_pol() local 6254 t7951 = t163 * t447; in func_pol() 6259 … t149 * t7946 - 0.400e3 / 0.9e1 * t517 * t7946 - 0.400e3 / 0.9e1 * t155 * t7951 - 0.40e2 / 0.9e1 *… in func_pol() 6278 …t8018 = -0.280e3 / 0.9e1 * t496 * t7971 + 0.20e2 * t2989 * t1575 - 0.440e3 / 0.9e1 * t524 * t7951 … in func_pol() 6314 …0.80e2 / 0.3e1 * t566 * t7932 - 0.400e3 / 0.9e1 * t200 * t7951 - 0.440e3 / 0.9e1 * t592 * t7951 - … in func_pol()
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H A D | mgga_x_m11_l.c | 209 double t7912, t7918, t7925, t7948, t7951, t7960, t8049, t8054; in func_unpol() local 1786 t7951 = t2752 * t59 * t6988; in func_unpol() 1787 …3 * t1726 * t1181 * sigma[0] + 0.50724007620911424162e-6 * t7948 * t150 * t7951 - 0.15573661157440… in func_unpol() 1788 …3 * t1726 * t1540 * sigma[0] + 0.50724007620911424162e-6 * t7948 * t228 * t7951 - 0.15573661157440… in func_unpol() 4235 double t7932, t7940, t7942, t7950, t7951, t7952, t7953, t7957; in func_pol() local 7031 t7951 = t3073 / 0.3e1; in func_pol() 7372 …t8976 = -t7951 - t7952 - t7953 - t3286 - t3412 - t2857 + t7940 - t2696 / 0.2e1 - t2670 + t10 * (t7… in func_pol() 7646 …e1 * t2868 - t4142 - t2682 - t1880 + t7942 - t1862 + t10 * (t9012 + t9048 + t9443 + t9853) - t7951; in func_pol()
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H A D | mgga_c_pkzb.c | 2902 double t7942, t7948, t7951, t7953, t7956, t7959, t7961, t7963; in func_pol() local 8417 t7951 = t155 * t819; in func_pol() 8418 t7953 = t170 * t2214 * t7951; in func_pol() 14730 …t7951 - 0.68598428988911579156e-2 * t4639 * t170 * t2169 * t26606 + 0.17149607247227894789e-2 * t1… in func_pol() 14844 …t170 * t2169 * t7421 + 0.17149607247227894789e-2 * t1319 * t170 * t7376 * t7951 - 0.17149607247227… in func_pol() 14997 …e1 / 0.12e2 * t28136 + 0.25724410870841842183e-2 * t1319 * t170 * t7908 * t7951 - 0.51448821741683… in func_pol() 14999 …170 * t2176 * t28113 + 0.25724410870841842183e-2 * t1319 * t170 * t7885 * t7951 - 0.25724410870841… in func_pol() 15486 …1 * t4639 * t170 * t2169 * t2894 * t819 + 0.10289764348336736873e-1 * t1319 * t170 * t9561 * t7951; in func_pol() 18622 t49411 = t13047 * t44637 * t834 * t7951; in func_pol()
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H A D | mgga_x_tpss.c | 3703 double t7920, t7922, t7925, t7928, t7932, t7933, t7951, t7957; in func_pol() local 7001 t7951 = t543 * t9; in func_pol() 7014 …t3047 * t745 + 0.2e1 * t3568 * t1394 * t7951 * t352 + t7957 * t1386 * t3047 * t711 / 0.9e1 - t7962… in func_pol()
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H A D | mgga_c_m06l.c | 5919 double t7951, t7952, t7954, t7955, t7957, t7958, t7960, t7962; in func_pol() local 11694 t7951 = t418 * t2498; in func_pol() 11695 t7952 = t7951 * t470; in func_pol() 18055 …0 - 0.60000000000000000000e1 * t7650 * t7997 + 0.37500000000000000000e0 * t7951 * t2100 - 0.269452… in func_pol() 18401 …t23034 = 0.30000000000000000000e1 * t7951 * t2140 - 0.12061484624019401300e2 * t6065 * t2635 + 0.3… in func_pol() 19961 … - 0.62500000000000000001e-1 * t7668 * t3548 - 0.12500000000000000000e0 * t7951 * t3548 - 0.125000… in func_pol() 19980 … - 0.15545350000000000000e-1 * t6844 * t1128 + 0.10000000000000000000e1 * t7951 * t3599 - 0.388633… in func_pol() 20015 …t37419 = -0.62500000000000000001e-1 * t7948 * t3604 - 0.12500000000000000000e0 * t7951 * t3604 - 0… in func_pol() 20750 …6 + 0.12500000000000000000e0 * t7954 * t4138 + 0.12500000000000000000e0 * t7951 * t4138 - 0.266666… in func_pol()
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H A D | mgga_xc_b98.c | 5840 double t7948, t7950, t7951, t7953, t7954, t7956, t7957, t7958; in func_pol() local 11370 t7951 = t1629 * t7950; in func_pol() 11371 …356273148148148e-5 * t7946 - 0.60389606172839506174e-3 * t7948 + 0.70707818930041152263e-3 * t7951; in func_pol() 17737 …* t7939 + 0.20129868724279835392e-2 * t7948 - 0.35353909465020576132e-2 * t7951 - 0.42622155491970… in func_pol() 18232 …* t7939 - 0.80519474897119341560e-2 * t7948 + 0.14141563786008230452e-1 * t7951 + 0.17048862196788… in func_pol()
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H A D | mgga_xc_b97mv.c | 4019 double t7950, t7951, t7952, t7953, t7954, t7955, t7956, t7957; in func_pol() local 8822 t7951 = 0.30000000000000000000e1 * t7950; in func_pol() 9230 …+ t7958 + t7960 + t8783 + t8381 + t8758 + t8407 - t4163 + t7947 + t7949 + t7951 + t7945 + t8173 + … in func_pol() 13547 …80e4 * t7061 - 0.60000000000000000000e1 * t7063 + t7945 + t7947 + t7949 + t7951 + t7953 + t7956 + … in func_pol()
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H A D | mgga_c_kcis.c | 4924 double t7943, t7946, t7947, t7950, t7951, t7954, t7955, t7958; in func_pol() local 11511 t7951 = t2666 * t7950; in func_pol() 11602 …00000000000000000e0 * t3986 * t7947 + 0.40468749999999999999e-1 * t2665 * t7951 - 0.13489583333333… in func_pol() 21241 …00e-1 * t1354 * t495 * t477 * t32190 + 0.16187500000000000000e0 * t7939 * t7951 - 0.53958333333333… in func_pol() 23906 …749999999999999e-1 * t15963 * t7962 - 0.21583333333333333333e0 * t15914 * t7951 + 0.22500000000000… in func_pol() 24021 …000000000000000e0 * t15892 * t8208 + 0.40468749999999999999e-1 * t15963 * t7951 - 0.18750000000000… in func_pol() 28189 …000000000000000e0 * t25066 * t7947 + 0.80937500000000000001e-1 * t25090 * t7951 + 0.60703125000000… in func_pol()
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H A D | mgga_c_scanl.c | 351 double t7933, t7934, t7938, t7942, t7948, t7951, t7952, t7955; in func_unpol() local 3303 t7951 = t2586 * t142; in func_unpol() 3304 t7952 = t769 * t7951; in func_unpol() 3681 t10151 = t1032 * t7951; in func_unpol() 3732 t10365 = t1024 * t7951; in func_unpol() 3985 t12020 = t1194 * t7951; in func_unpol() 3991 t12067 = t1187 * t7951; in func_unpol() 4017 …t12237 = -0.10979019874935515226e0 * t4109 * t343 - 0.119078225334763520e0 * t790 * t1209 * t7951 … in func_unpol()
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H A D | mgga_x_br89.c | 14207 double t7947, t7948, t7950, t7951, t7952, t7955, t7958, t7959; in func_ferr() local 18370 t7951 = t312 * t7950; in func_ferr() 18371 t7952 = t297 * t7951; in func_ferr() 24622 t42462 = t1612 * t7951; in func_ferr() 26836 t53201 = t1946 * t7951; in func_ferr() 27363 t57405 = t479 * t7951; in func_ferr() 27364 t57407 = t2440 * t7951; in func_ferr() 27402 t57625 = t487 * t7951; in func_ferr() 27554 t59125 = t3173 * t7951; in func_ferr() 39131 t7951 = t3259 * t1663; in func_pol() [all …]
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H A D | mgga_x_br89_explicit.c | 14123 double t7947, t7948, t7949, t7950, t7951, t7952, t7953, t7954; in func_pol() local 20281 t7951 = t779 * t1008; in func_pol() 20282 t7952 = t1006 * t7951; in func_pol() 27877 t31009 = t3754 * t7951; in func_pol() 27989 … + 0.14465105062336032227e0 * t31479 - 0.21697657593504048340e0 * t4389 * t7951 - t31484 - 0.4e1 /… in func_pol() 29761 …512145021e0 * t2219 * t5547 - t42185 - 0.21697657593504048340e0 * t5531 * t7951 - 0.43395315187008… in func_pol() 30826 …5315187008096680e0 * t49170 - t49173 - 0.21697657593504048340e0 * t6754 * t7951 - 0.43395315187008… in func_pol() 31341 …8 + t52701 + t52703 - 0.14465105062336032227e0 * t52705 - 0.43395315187008096680e0 * t7940 * t7951; in func_pol()
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/dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
H A D | lda_c_pmgb06.c | 1778 double t7942, t7944, t7945, t7946, t7947, t7948, t7951, t7954; in func_pol() local 6475 t7951 = 0.26116266666666666667e1 * t4032 * t4033 * t616; in func_pol() 6483 …t7988 = t7948 - t7951 + t7954 - t7957 + t7960 - 0.17628480000000000000e3 * t57 * t4054 * t1155 * t… in func_pol() 8636 …34 - 0.14690400000000000000e1 * t7938 + 0.68555200000000000000e1 * t7942 + t13382 + t13383 - t7951; in func_pol() 8877 …* t14077 - 0.11752320000000000000e3 * t13254 * t14092 + t14208 + t14209 - t7951 + t7954 + 0.176284… in func_pol() 11083 …* t20352 + t20355 - 0.88142400000000000000e2 * t13254 * t20351 - t20359 - t7951 + t7954 - t20362 -… in func_pol() 11179 …t20855 = t20830 - t20833 - 0.14690400000000000000e1 * t57 * t351 * t20788 + t20839 - t7951 + t7954… in func_pol()
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