| /dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
| H A D | gga_x_am05.c | 1760 double t4164, t4178, t4179, t4188, t4196, t4205, t4217, t4221; in func_pol() local
3399 t4179 = t1812 * t4178; in func_pol()
3402 … t779 + 0.884e3 / 0.9e1 * t321 * t4145 * t1826 + 0.150e3 * t321 * t4145 * t4179 - 0.2079e4 / 0.16e… in func_pol()
3581 …1820 - 0.325e3 / 0.12e2 * t426 * t1827 - 0.225e3 / 0.4e1 * t426 * t1807 * t4179 + 0.6237e4 / 0.128… in func_pol()
3679 …3 - 0.891e3 / 0.128e3 * t1143 * t2305 + 0.675e3 / 0.32e2 * t1143 * t769 * t4179 - 0.9e1 / 0.64e2 *… in func_pol()
3798 …e4 / 0.512e3 * t2876 * t322 * t4153 - 0.2025e4 / 0.256e3 * t2876 * t322 * t4179 + 0.56133e5 / 0.81… in func_pol()
3867 … 0.729e3 / 0.256e3 * t7037 * t2892 + 0.6075e4 / 0.2048e4 * t7037 * t427 * t4179 + 0.9e1 / 0.64e2 *… in func_pol()
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| H A D | gga_xc_th2.c | 537 double t4173, t4175, t4177, t4179, t4181, t4185, t4188, t4192; in func_pol() local
1896 t4179 = t308 * t1828; in func_pol()
1903 ….7040e4 / 0.27e2 * t4175 - 0.1408e4 / 0.9e1 * t4177 - 0.1280e4 / 0.27e2 * t4179 - 0.640e3 / 0.9e1 … in func_pol()
1930 …t4282 = -0.704e3 / 0.9e1 * t4177 - 0.640e3 / 0.27e2 * t4179 + 0.640e3 / 0.9e1 * t4217 - 0.320e3 / … in func_pol()
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| H A D | gga_x_n12.c | 1171 double t4171, t4172, t4177, t4178, t4179, t4181, t4194, t4205; in func_pol() local
2791 t4179 = t4133 + t4178; in func_pol()
2794 …* t1798 * t4090 - 0.360e3 * t1807 * t4090 - t341 * t4179 - 0.2e1 * t355 * t4179 - 0.3e1 * t360 * t… in func_pol()
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| H A D | gga_x_bpccac.c | 1484 double t4122, t4134, t4139, t4144, t4145, t4152, t4179, t4188; in func_pol() local
3007 t4179 = t424 * t1129; in func_pol()
3008 …* t1246 * t18 + 0.176e3 / 0.3e1 * t466 * t1251 * t18 + 0.448e3 / 0.27e2 * t4179 * t742 * sigma[0] … in func_pol()
3021 …0.3e1 * t1845 * t521 - t795 * t1193 + t4335) + 0.20073974006931581138e1 * t4179 * t428 * t1890 + 0… in func_pol()
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| H A D | gga_c_op_b88.c | 847 double t4166, t4167, t4170, t4171, t4174, t4175, t4178, t4179; in func_pol() local
2825 t4179 = t672 * t4178; in func_pol()
2841 …60019230000000000000e0 * t207 * t4175 + 0.30009615000000000000e0 * t207 * t4179 + 0.15000000000000… in func_pol()
4618 t16334 = 0.60019230000000000000e0 * t551 * t4179; in func_pol()
4621 …60019230000000000000e0 * t554 * t4175 + 0.30009615000000000000e0 * t554 * t4179 + 0.30009615000000… in func_pol()
4809 …000000000000e0 * t207 * t2392 * t4178 + 0.30009615000000000000e0 * t706 * t4179 + 0.30009615000000… in func_pol()
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| H A D | gga_x_gg99.c | 170 double t4179, t4184, t4192, t4204, t4224, t4228, t4237, t4243; in func_unpol() local
1370 t4179 = t562 * t1004; in func_unpol()
1394 … + t4023 + t4078 + t4127 + t4170) * t142 - 0.6e1 * t4176 * t369 + 0.9e1 * t4179 * t1006 - 0.6e1 * … in func_unpol()
1488 … * t5375 * t1006 - 0.2e1 * t2044 * t1045 - 0.2e1 * t4176 * t739 + 0.6e1 * t4179 * t2049 - 0.4e1 * … in func_unpol()
1583 … * t5372 * t739 + 0.6e1 * t5375 * t2049 - 0.4e1 * t2044 * t2095 + 0.3e1 * t4179 * t2441 - 0.15e2 /… in func_unpol()
3651 double t4171, t4172, t4173, t4174, t4176, t4177, t4178, t4179; in func_pol() local
6437 t4179 = t879 * t4178; in func_pol()
6467 …4070 + 0.8e1 / 0.27e2 * t4168 - 0.4e1 / 0.81e2 * t4174 - 0.8e1 / 0.81e2 * t4179 - 0.4e1 / 0.27e2 *… in func_pol()
8593 t12704 = 0.16e2 / 0.81e2 * t4179; in func_pol()
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| H A D | gga_x_ncap.c | 2305 double t4159, t4164, t4178, t4179, t4180, t4182, t4194, t4195; in func_pol() local
4094 t4179 = t4178 / 0.9e1; in func_pol()
4102 …2e1 - t532 * t1532 * t1536 / 0.2e1 - t532 * t533 * t199 * t1177 / 0.6e1 + t4179 + 0.7e1 / 0.6e1 * … in func_pol()
4162 …- t4432 / 0.2e1 - t4435 / 0.2e1 + t4441 / 0.9e1 + t4451 - t4454 / 0.2e1 + t4179 + t4195 + t1523 * … in func_pol()
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| H A D | gga_x_sfat_pbe.c | 3372 double t4157, t4158, t4166, t4172, t4179, t4187, t4189, t4193; in func_pol() local
5573 t4179 = t553 * t569 * t1326; in func_pol()
5621 …51270024593171112e-3 * t1523 * t3214 * t1525 - 0.81694493584227555384e0 * t4179 * t1588 + 0.134148… in func_pol()
7105 … + 0.24508348075268266615e1 * t4179 * t4189 + 0.75039341535660098113e-2 * t3215 * t1525 - 0.122541… in func_pol()
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| H A D | hyb_gga_xc_wb97.c | 2001 double t4140, t4149, t4153, t4156, t4157, t4158, t4172, t4179; in func_pol() local
4989 t4179 = t112 * t91; in func_pol()
4992 …109 - 0.4608e-8 * t1204 * t120 + 0.12288e-10 * t104 * t1215 + 0.3072e-8 * t4179 * t120 - 0.32768e-… in func_pol()
8496 …+ 0.65536000000000000002e-12 * t543 * t3814 - 0.32768000000000000000e-7 * t4179 * t547 + 0.5679786… in func_pol()
8688 …- 0.245760e-12 * t104 * t4185 + 0.6144e-8 * t13245 * t120 - 0.147456e-9 * t4179 * t1215 + 0.983040… in func_pol()
12352 …-6 * t90 * t1614 * t38134 + 0.27648e-4 * t4172 * t1604 + 0.38229333333333333333e-6 * t4179 * t1615; in func_pol()
12515 …t39557 = -0.65536000000000000000e-7 * t13245 * t547 + 0.22282240000000000000e-8 * t4179 * t559 - 0… in func_pol()
12633 …e-8 * t112 * t117 * t119 - 0.393216e-9 * t13245 * t1215 + 0.5898240e-11 * t4179 * t4185 - 0.314572… in func_pol()
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| H A D | gga_c_pbeloc.c | 2066 double t4174, t4175, t4177, t4178, t4179, t4182, t4183, t4185; in func_pol() local
4931 t4179 = t4178 * t1358; in func_pol()
4951 …* t4169 + 0.40372756094140390854e-3 * t4175 + 0.16956557559538964159e-1 * t4179 - 0.12111826828242… in func_pol()
5097 …* t4169 + 0.80745512188280781706e-3 * t4175 + 0.33913115119077928316e-1 * t4179 - 0.24223653656484… in func_pol()
5201 …t4703 = 0.84782787797694820794e-2 * t4179 + 0.7e1 / 0.144e3 * t4186 - 0.7e1 / 0.2304e4 * t4676 + 0… in func_pol()
5346 …t5012 = 0.16956557559538964158e-1 * t4179 + t4187 - t5004 + 0.67287926823567318088e-4 * t4681 + t4… in func_pol()
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
| H A D | mgga_x_revtm.c | 4757 double t4176, t4179, t4182, t4187, t4189, t4194, t4198, t4199; in func_pol() local
6838 t4179 = t243 * t509; in func_pol()
7480 …4169 * t2174 + 0.75465869629629629630e0 * t1534 * t6012 - 0.12577644938271604938e1 * t4179 * t2174; in func_pol()
8783 …4 - 0.37732934814814814814e1 * t4179 * t4182 + 0.22639760888888888889e1 * t4169 * t4182 - 0.188664… in func_pol()
9247 …33333e1 * t4175 * t4021 * t488 * t768 * t744 + 0.50310579753086419754e0 * t4179 * t5178 + (t14344 … in func_pol()
9250 …919282666666666668e1 * t4175 * t1535 * t3244 + 0.50310579753086419753e0 * t4179 * t5189 - 0.6e1 * … in func_pol()
9251 ….12e2 * t1513 * t3345 - 0.6e1 * t5160 * t781 - 0.25155289876543209876e1 * t4179 * t5181 + 0.113198… in func_pol()
9493 … * t5313 * t612 * t787 + 0.10062115950617283950e1 * t4179 * t5917 - 0.50310579753086419753e1 * t41… in func_pol()
9871 …0.50e2 * t3504 * t5172 - 0.12577644938271604938e1 * t4179 * t6771 - 0.62888224691358024692e0 * t41… in func_pol()
10151 …445e2 * t11076 * t7065 + 0.50310579753086419753e0 * t4179 * t7058 - 0.25155289876543209877e1 * t41… in func_pol()
[all …]
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| H A D | mgga_c_cs.c | 809 double t4166, t4169, t4170, t4172, t4178, t4179, t4182, t4183; in func_pol() local
2893 t4179 = t1409 * t545; in func_pol()
2897 …00000000000e-1 * t1507 * t527 * t43 - t4178 + 0.15426559232088888889e-3 * t4179 - t4182 - 0.100694… in func_pol()
2955 …t4447 = 0.30853118464177777778e-3 * t4179 - t4182 - 0.20138882133333333332e-2 * t4183 - 0.14616558… in func_pol()
2972 …174661333333332e-2 * t4170 + 0.12752947110933333333e-2 * t4172 + 0.46279677696266666667e-3 * t4179; in func_pol()
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| H A D | mgga_x_rtpss.c | 3078 double t4132, t4146, t4155, t4158, t4162, t4167, t4172, t4179; in func_pol() local
5334 t4179 = t2038 * t249; in func_pol()
5340 …t1358 * t1367 + 0.1971e4 / 0.100e3 * t2030 * t1781 - 0.5913e4 / 0.200e3 * t4179 * t4180 - 0.1971e4… in func_pol()
5718 …t1358 * t1665 + 0.1971e4 / 0.100e3 * t2706 * t1781 - 0.5913e4 / 0.200e3 * t4179 * t4769 + 0.1971e4… in func_pol()
6981 …t4179 * t4117 * t308 - 0.219e3 / 0.800e3 * t3126 * t1742 * t796 - 0.73e2 / 0.100e3 * t1363 * t4113… in func_pol()
7505 …2189 * t4180 - 0.5913e4 / 0.200e3 * t10482 * t4769 - 0.5913e4 / 0.200e3 * t4179 * t1746 * t1151 - … in func_pol()
7509 …300e3 * t9650 * t626 + 0.73e2 / 0.300e3 * t4172 * t3849 + 0.5913e4 / 0.50e2 * t4179 * t4117 * t501; in func_pol()
7704 …189 - 0.478953e6 / 0.20e2 * t12816 * t4915 * t308 + 0.53217e5 / 0.200e3 * t4179 * t4911 * t308 - 0… in func_pol()
8086 …2 / 0.100e3 * t298 * t1742 + t4728 * t473 / 0.12e2 - 0.5913e4 / 0.200e3 * t4179 * t1746 * t1520 + … in func_pol()
8296 …12811 * t4769 - 0.73e2 / 0.400e3 * t12808 * t1662 + 0.53217e5 / 0.200e3 * t4179 * t4911 * t501 - 0… in func_pol()
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| H A D | hyb_mgga_x_m05.c | 2284 double t4157, t4158, t4163, t4164, t4169, t4170, t4175, t4179; in func_pol() local
4412 t4179 = t179 * t4146; in func_pol()
4413 t4180 = t4179 * tau[1]; in func_pol()
6363 …t4179 + 0.1500e4 * t1075 * t4163 + 0.2700e4 * t1084 * t4169 + 0.30e2 * t137 * t4191 + 0.1680e4 * t… in func_pol()
6367 …e4 * t2817 * t4183 + 0.4950e4 * t2830 * t4187 + 0.120e3 * t2847 * t4191 + 0.2520e4 * t2879 * t4179; in func_pol()
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| H A D | mgga_x_tau_hcth.c | 1445 double t4176, t4179, t4192, t4204, t4221, t4229, t4238, t4247; in func_pol() local
3345 t4179 = 0.4e1 / 0.3e1 * t1936 * t1967; in func_pol()
3347 …9 * t1956 * t1498 / 0.6e1 + t1948 * t899 * t456 / 0.2e1 - t4176 / 0.6e1 - t4179 - t377 * t677 * t9… in func_pol()
3362 …+ 0.4e1 / 0.3e1 * t4161 - 0.2e1 / 0.9e1 * t4093 + t4100 - t4176 / 0.3e1 - t4179 - 0.2e1 / 0.9e1 * … in func_pol()
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| H A D | mgga_x_mbrxc_bg.c | 30919 t4179 = t213 * t477; in func_pol()
30920 t4180 = t4179 * t1585; in func_pol()
30932 t4195 = t4179 * t4194; in func_pol()
30936 t4200 = t4179 * t1553; in func_pol()
30975 t4257 = t4179 * t4256; in func_pol()
30990 t4276 = t4179 * t1580; in func_pol()
31051 t4373 = t4179 * t1537; in func_pol()
31070 t4405 = t4179 * t1546; in func_pol()
32690 t6598 = t4179 * t1566; in func_pol()
32698 t6608 = t4179 * t1558; in func_pol()
[all …]
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| H A D | mgga_c_b88.c | 2689 double t4164, t4167, t4169, t4172, t4173, t4177, t4179, t4180; in func_pol() local
5875 t4179 = t215 * t337 * t4177; in func_pol()
5876 t4180 = t334 * t4179; in func_pol()
8602 …40 + 0.56000000000000000000e-1 * t11387 * t440 - t11207 + 0.29826161777777777781e-2 * t739 * t4179; in func_pol()
8673 … - 0.24000000000000000000e1 * t11767 + 0.11184810666666666668e-2 * t328 * t4179 - 0.69594377481481… in func_pol()
8690 …78485333333333343e-2 * t2754 * t1371 + 0.89478485333333333343e-2 * t991 * t4179 - 0.37282702222222… in func_pol()
8707 …860929422222222225e-1 * t979 * t4119 - 0.11930464711111111112e-1 * t979 * t4179 - 0.29037037037037… in func_pol()
9496 …t1500 * t4179 + 0.74565404444444444452e-3 * t1500 * t4119 + 0.37282702222222222226e-3 * t13863 * t… in func_pol()
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| H A D | mgga_x_m11.c | 1580 double t3968, t3997, t4038, t4046, t4052, t4063, t4111, t4179; in func_ferr() local
2565 t4179 = t86 * t2 * t4; in func_ferr()
2569 …v4rho3sigma[0] = t4179 * t417 / 0.9e1 - t2077 * t938 / 0.2e1 - t2077 * t966 / 0.2e1 - 0.3e1 / 0.2e… in func_ferr()
2639 …v4rho3tau[0] = t4179 * t526 / 0.9e1 - t2077 * t971 / 0.2e1 - t2077 * t1255 / 0.2e1 - 0.3e1 / 0.2e1… in func_ferr()
3034 double t4160, t4161, t4171, t4176, t4179, t4182, t4185, t4190; in func_pol() local
5068 t4179 = t1555 * t2795; in func_pol()
5073 …4 * t4171 + 0.4840e4 / 0.27e2 * t161 * t4176 - 0.48400e5 / 0.9e1 * t524 * t4179 - 0.400e3 / 0.3e1 … in func_pol()
5078 …0 * t4211 - 0.40000e5 / 0.9e1 * t517 * t4218 - 0.22000e5 / 0.9e1 * t155 * t4179 - 0.22000e5 / 0.9e… in func_pol()
5154 …8 - 0.2000e4 * t1682 * t4211 - 0.40000e5 / 0.9e1 * t587 * t4218 - 0.22000e5 / 0.9e1 * t200 * t4179; in func_pol()
5156 …t4618 = -0.22000e5 / 0.9e1 * t1690 * t4218 - 0.48400e5 / 0.9e1 * t592 * t4179 + 0.5000e4 / 0.9e1 *… in func_pol()
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| H A D | mgga_x_msb.c | 3123 double t4178, t4179, t4185, t4186, t4189, t4190, t4191, t4216; in func_pol() local
5384 t4179 = t4178 * t49; in func_pol()
5387 … * t370 * t1124 + 0.3e1 / 0.8e1 * t1110 * t4175 - 0.3e1 / 0.16e2 * t791 * t4179 + 0.6e1 * t1619 * … in func_pol()
6915 …t11802 = -0.21e2 / 0.16e2 * t164 * t73 * t1498 * t56 - 0.3e1 / 0.16e2 * t2275 * t4179 - 0.3e1 / 0.… in func_pol()
6920 … * t356 + 0.3e1 / 0.8e1 * t1110 * t4174 * t977 - 0.3e1 / 0.16e2 * t3051 * t4179 + 0.12e2 * t2242 *… in func_pol()
7561 … t9644 * t4020 + 0.9e1 / 0.4e1 * t9545 * t3987 - 0.9e1 / 0.16e2 * t3120 * t4179 + 0.9e1 / 0.8e1 * … in func_pol()
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| H A D | mgga_x_mvs.c | 2061 double t4179, t4181, t4188, t4196, t4214, t4220, t4227, t4230; in func_pol() local
4716 t4179 = t4178 * t1546; in func_pol()
4724 …t4232 = t4173 * t1545 * t1485 / 0.3888e4 - t4179 / 0.3888e4 - t3857 * t3842 * t65 * t4181 / 0.1296… in func_pol()
4780 …48e5 + t4188 * t1545 * t116 * t4641 / 0.864e3 - t4647 * t1546 / 0.864e3 - t4179 / 0.2592e4 - t4214… in func_pol()
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| H A D | mgga_xc_b97mv.c | 3819 double t4171, t4172, t4174, t4176, t4178, t4179, t4180, t4181; in func_pol() local
7217 t4179 = t4178 * t13; in func_pol()
7220 t4183 = t4179 * t18 * t4181; in func_pol()
9030 t8410 = t4179 * t18 * t8408; in func_pol()
12045 …233 + 0.6e1 * t1739 * t1859 - 0.38596750796862084160e3 * t16709 * t5194 + t4179 * t18 * t5265 * t4… in func_pol()
12066 t16979 = t4179 * t127 * t4181; in func_pol()
13214 t24129 = t4179 * t127 * t8408; in func_pol()
13545 …32e2 * t387 * t18 * t2235 * t7120 - t387 * t18 * t390 * t24353 / 0.32e2 + t4179 * t18 * t5265 * t7… in func_pol()
13816 … t28652 - t28660 / 0.16e2 - 0.3e1 / 0.32e2 * t323 * t18 * t28662 * t314 + t4179 * t18 * t9122 * t4… in func_pol()
14263 …2e2 - t31264 / 0.24e2 + t30176 / 0.48e2 - 0.3e1 / 0.32e2 * t8795 * t911 + t4179 * t18 * t9122 * t7… in func_pol()
[all …]
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| H A D | mgga_x_pbe_gx.c | 2637 double t4150, t4165, t4168, t4171, t4174, t4177, t4179, t4181; in func_pol() local
5443 t4179 = t1395 * t10; in func_pol()
5444 t4181 = t9 / t4179; in func_pol()
5645 t5335 = 0.1e1 / t134 / t4179; in func_pol()
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| H A D | mgga_x_sa_tpss.c | 3936 double t4159, t4161, t4164, t4168, t4170, t4171, t4179, t4183; in func_ferr() local
5622 …t4179 = -0.25e2 / 0.1024e4 * t4054 - 0.25e2 / 0.9216e4 * t4058 - 0.25e2 / 0.27648e5 * t4062 - 0.25… in func_ferr()
5648 …t4242 = 0.2e1 / 0.45e2 * t156 * t159 * t4179 - t4185 / 0.24e2 - 0.5e1 / 0.384e3 * t4189 - t4193 / … in func_ferr()
6748 …25e3 / 0.93312e5 * t1792 * t1836 * t6284 - 0.4e1 / 0.45e2 * t156 * t526 * t4179 * t258 - 0.25e2 / … in func_ferr()
6772 …288 * t11161 / 0.12e2 + 0.5e1 / 0.192e3 * t6082 * t1141 * t11165 - t514 * t4179 * t135 * t145 / 0.… in func_ferr()
6778 t11223 = t158 * t4179; in func_ferr()
7101 … * t156 * t1822 * t1133 * t1226 + t5308 * t288 * t14114 / 0.27e2 + t514 * t4179 * t18 * t145 / 0.1… in func_ferr()
7112 …0.16e2 / 0.15e2 * t156 * t5873 * t14175 - 0.16e2 / 0.45e2 * t156 * t526 * t4179 * t349 - 0.25e2 / … in func_ferr()
7157 …5873 * t428 * t4216 - t127 * t12229 * t316 / 0.24e2 + t127 * t972 * t69 * t4179 / 0.9e1 - 0.5e1 / … in func_ferr()
7162 … * t69 + 0.25e2 / 0.384e3 * t1995 * t12328 * t3243 - t514 * t379 * t166 * t4179 / 0.81e2 - 0.5e1 /… in func_ferr()
[all …]
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| H A D | mgga_x_m06l.c | 143 double t4051, t4083, t4116, t4148, t4152, t4157, t4173, t4179; in func_unpol() local
1205 t4179 = t943 * t653 * t610; in func_unpol()
1206 …3 * t2454 * t4173 - 0.71702784e0 * t922 * t4179 + 0.33471935112960e-2 * t2463 * t4173 + 0.192e3 * … in func_unpol()
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
| H A D | lda_xc_bn05.c | 956 double t4165, t4167, t4169, t4171, t4173, t4175, t4177, t4179; in func_pol() local
2860 t4179 = t174 * t203 * t4177; in func_pol()
2865 ….36e2 - t4163 / 0.6e1 + t4167 / 0.36e2 + t4171 / 0.6e1 - t4175 / 0.24e2 - t4179 / 0.24e2 - t4183 /… in func_pol()
4114 …t10223 = t4167 / 0.18e2 + t4171 / 0.3e1 - t4175 / 0.12e2 - t4179 / 0.12e2 - t4183 / 0.6e1 - t4187 … in func_pol()
4277 …0.12e2 - t4163 / 0.2e1 + t4167 / 0.12e2 + t4171 / 0.2e1 - t4175 / 0.8e1 - t4179 / 0.8e1 - t4183 / … in func_pol()
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