| /dports/science/libxc/libxc-5.0.0/src/maple2c/gga_exc/ |
| H A D | gga_c_sogga11.c | 2646 t4620 = t1707 * t39; in func_ferr()
6097 t4620 = t1037 * t944; in func_pol()
6098 t4621 = t370 * t4620; in func_pol()
6221 t4856 = t361 * t4620; in func_pol()
6247 t4904 = t364 * t4620; in func_pol()
6249 t4908 = t367 * t4620; in func_pol()
9968 t15224 = t1096 * t4620; in func_pol()
10121 t15543 = t1077 * t4620; in func_pol()
10211 t15736 = t1115 * t4620; in func_pol()
10233 t15791 = t1089 * t4620; in func_pol()
[all …]
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| H A D | gga_x_gg99.c | 1850 double t4526, t4530, t4533, t4539, t4550, t4571, t4620, t4634; in func_ferr() local
3085 …t4620 = -0.8e1 / 0.3e1 * t1283 * t631 - t184 * t185 * t4341 * t186 / 0.9e1 - t449 * t1729 / 0.3e1 … in func_ferr()
3089 v4rho3sigma[0] = t3601 + t4427 + t4472 + t4503 + t4539 + t4571 + t4620 + t4653; in func_ferr()
3681 double t4611, t4612, t4615, t4619, t4620, t4623, t4625, t4628; in func_pol() local
6683 t4620 = t29 * t4619; in func_pol()
6686 … * t4608 / 0.8e1 - t1404 * t4612 / 0.16e2 + t339 * t342 * t4615 / 0.8e1 - t4620 * t1407 / 0.8e1 + … in func_pol()
8210 …t10279 = -0.3e1 / 0.4e1 * t4620 * t3085 - t1404 * t1405 * t3032 * t333 / 0.4e1 + 0.1505e4 / 0.16e2… in func_pol()
8796 …t4620 * t4625 - 0.3e1 / 0.8e1 * t4620 * t4608 - 0.3e1 / 0.16e2 * t1404 * t1405 * t4602 * t333 - 0.… in func_pol()
9302 … 0.16e2 * t4620 * t5633 + 0.3e1 / 0.32e2 * t1404 * t4623 * t1744 * t953 - t4620 * t5637 / 0.4e1 - … in func_pol()
9632 …2 * t6398 * t333 + 0.9e1 / 0.32e2 * t1404 * t4623 * t1744 * t1432 - 0.3e1 / 0.16e2 * t4620 * t6404; in func_pol()
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| H A D | gga_x_n12.c | 1182 double t4611, t4612, t4613, t4618, t4620, t4622, t4624, t4626; in func_pol() local
2879 t4620 = t7 * t4618 * t2086; in func_pol()
2883 …1 * t4607 - 0.5e1 / 0.27e2 * t7 * t4612 * t113 * t4613 + 0.4e1 / 0.27e2 * t4620 + 0.2e1 / 0.9e1 * … in func_pol()
2941 …t4918 = t4607 / 0.3e1 + t4620 / 0.27e2 + t4624 / 0.9e1 - t4638 / 0.6e1 - t4641 / 0.2e1 - t4644 / 0… in func_pol()
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| H A D | gga_x_ev93.c | 972 double t4599, t4602, t4604, t4608, t4616, t4620, t4653, t4668; in func_pol() local
2726 …t4620 = t1570 - t1583 + t1587 - t4329 + t1551 + 0.2e1 / 0.3e1 * t1562 - t1566 + t1475 + t3973 - t1… in func_pol()
2728 …8] = t4616 - t3976 + t1666 + t1671 + t1673 + t1675 + t1678 + t1682 - t1685 - t1690 - t1694 + t4620; in func_pol()
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| H A D | hyb_gga_xc_wb97.c | 2021 double t4618, t4619, t4620, t4621, t4624, t4625, t4628, t4629; in func_pol() local
5151 t4620 = t4619 * t1372; in func_pol()
5152 t4621 = t4618 * t4620; in func_pol()
6626 t7998 = t7997 * t4620; in func_pol()
8862 …8e1 / 0.27e2 * t1553 * t4618 * t13855 + 0.2e1 / 0.27e2 * t1553 * t13859 * t4620 + 0.4e1 / 0.27e2 *… in func_pol()
8924 …8e1 / 0.81e2 * t1553 * t8044 * t13691 + 0.2e1 / 0.27e2 * t1553 * t14077 * t4620 + 0.16e2 / 0.243e3… in func_pol()
10092 …t19914 = -0.2e1 / 0.9e1 * t1553 * t8075 * t6472 + t1553 * t19885 * t4620 / 0.27e2 - 0.4e1 / 0.27e2… in func_pol()
10154 …27e2 * t20178 + t20181 + t1553 * t8003 * t4628 / 0.9e1 + t1553 * t20185 * t4620 / 0.27e2 + 0.4e1 /… in func_pol()
11190 …264 * t4628 / 0.27e2 + t1553 * t27335 * t4620 / 0.81e2 + t1553 * t9268 * t4628 / 0.27e2 + t1553 * … in func_pol()
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| H A D | gga_x_ityh.c | 2625 double t4616, t4617, t4620, t4621, t4624, t4625, t4628, t4630; in func_pol() local
4689 t4620 = 0.9e1 / 0.8e1 * t7 * t17 * t4617; in func_pol()
4695 v3sigma3[0] = t9 * (-t4616 - t4620 - t4624 - t4628); in func_pol()
5763 v4rhosigma3[0] = t12702 * t9 - t4616 - t4620 - t4624 - t4628; in func_pol()
5798 …v4rhosigma3[10] = -t4616 - t4620 - t4624 - t4628 + t9 * (-t145 * t12042 * t276 / 0.2e1 - t12048 - … in func_pol()
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| H A D | gga_c_pw91.c | 2035 double t4615, t4616, t4617, t4619, t4620, t4621, t4622, t4623; in func_pol() local
5029 t4620 = t426 * t4619; in func_pol()
5030 t4621 = t179 * t4620; in func_pol()
7486 t12022 = t415 * t4620; in func_pol()
7488 …t12029 = -0.7e1 * t10064 - 0.7e1 / 0.2e1 * t10066 - t6815 + t12022 / 0.2e1 + t420 * t4620 / 0.2e1 … in func_pol()
7891 … t6886 + t6894 - t6902 - t6910 - 0.14e2 / 0.3e1 * t12109 + 0.2e1 * t514 * t4620 - 0.46520786582826… in func_pol()
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| H A D | gga_c_op_g96.c | 821 double t4620, t4625, t4645, t4647, t4649, t4654, t4662, t4669; in func_pol() local
3049 t4620 = t1103 * t1253; in func_pol()
3051 …1 * t4617 - 0.14385141280000000000e2 * t4305 - 0.40000000000000000000e1 * t4620 - 0.35962853200000… in func_pol()
3115 …0 + 0.53944279800000000000e1 * t4617 - t4306 - 0.60000000000000000000e1 * t4620 + 0.10788855960000… in func_pol()
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| H A D | gga_c_pbe.c | 1605 double t4619, t4620, t4621, t4622, t4623, t4624, t4627, t4628; in func_pol() local
4194 t4620 = t176 * t1524; in func_pol()
4195 t4621 = 0.16e2 * t4620; in func_pol()
4451 t5644 = 0.8e1 * t4620; in func_pol()
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| H A D | gga_c_revtca.c | 1331 double t4605, t4607, t4609, t4611, t4614, t4617, t4620, t4622; in func_pol() local
3953 t4620 = t225 * t4617 * t126 * t128; in func_pol()
3959 …t4644 = -t3471 + t3475 - 0.61739760092325925923e0 * t2821 + 0.43351786471668939195e-1 * t4620 + 0.… in func_pol()
3991 …1 * t4609 + 0.25004602837392000000e2 * t4611 + 0.17340714588667575678e0 * t4620 + 0.17340714588667… in func_pol()
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| H A D | gga_c_pbe_vwn.c | 2083 double t4616, t4620, t4622, t4625, t4628, t4631, t4637, t4638; in func_pol() local
4682 t4620 = t4430 * t472; in func_pol()
4687 … * t4616 * t477 + 0.3e1 * t1356 * t4564 - 0.3e1 * t1356 * t4622 - t1402 * t4620 - 0.2e1 * t1402 * … in func_pol()
6534 t13787 = t110 * t4620; in func_pol()
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| H A D | gga_x_chachiyo.c | 1440 double t4595, t4598, t4606, t4620, t4627, t4638, t4640, t4645; in func_pol() local
4382 …t4620 = -t4043 / 0.3e1 - 0.10e2 / 0.27e2 * t4046 - 0.41e2 / 0.9e1 * t4050 - 0.2e1 / 0.3e1 * t4054 … in func_pol()
4455 …t5009 = t8 * (t4521 + t4543 + t4581 + t4606 + t4620 + t4640 + t4680 + t4712 + t4741 + t4768 + t478… 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 | 2469 double t4620, t4621, t4624, t4630, t4633, t4640, t4641, t4644; in func_ferr() local
3855 t4620 = t369 * t1667; in func_ferr()
3856 t4621 = t4620 * t117; in func_ferr()
3998 t5998 = t4620 * t221; in func_ferr()
4771 double t4604, t4607, t4610, t4611, t4620, t4623, t4628, t4629; in func_pol() local
6971 t4620 = t243 * t496; in func_pol()
6978 …t4635 = -0.24e2 * t4620 * t1187 - 0.24e2 * t4632 * t1187 + 0.324e3 * t1200 * t4564 + 0.108e3 * t12… in func_pol()
7800 …1194 * t1967 - 0.12e2 * t1513 * t1765 + 0.54e2 * t3948 * t1762 - 0.24e2 * t4620 * t1947 - 0.12e2 *… in func_pol()
9857 …745 * t1947 - 0.24e2 * t12751 * t1947 - 0.24e2 * t4620 * t5132 - 0.24e2 * t4620 * t5135 - 0.24e2 *… in func_pol()
9860 …1194 * t5192 - 0.12e2 * t3217 * t1967 - 0.12e2 * t3217 * t1962 - 0.24e2 * t4620 * t5098 + 0.108e3 … in func_pol()
[all …]
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| H A D | mgga_x_rscan.c | 9771 t4620 = t1722 * t3409; in func_ferr()
18410 t4620 = t4615 * t363; in func_pol()
22280 t14045 = t4620 * t742; in func_pol()
23195 t15829 = t4620 * t1078; in func_pol()
23196 t15832 = t4620 * t1075; in func_pol()
28821 t42477 = t4620 * t2134; in func_pol()
28830 t42555 = t4620 * t2001; in func_pol()
30536 t49380 = t4620 * t2997; in func_pol()
30885 t51027 = t4620 * t3620; in func_pol()
31800 t53834 = t4620 * t4102; in func_pol()
[all …]
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| H A D | mgga_x_tpss.c | 3616 double t4615, t4616, t4620, t4621, t4625, t4626, t4629, t4630; in func_pol() local
5978 t4620 = t69 * t171 * t375; in func_pol()
5979 t4621 = t1586 * t4620; in func_pol()
7682 … t171 * t1122 / 0.16e2 + t1584 * t9509 * t1351 / 0.48e2 + t3606 * t3805 * t4620 / 0.12e2 + t11499 … in func_pol()
8240 … * t432 / 0.2e1 + t3767 * t4614 * t4445 * t432 / 0.3e1 - t11572 * t4446 * t4620 / 0.6e1 + 0.3e1 / … in func_pol()
8242 …4 / 0.8e1 - t1584 * t5385 * t465 * t105 * t432 / 0.12e2 + t3606 * t4615 * t4620 / 0.12e2 - t3767 *… in func_pol()
8463 …t15130 = t3606 * t4958 * t4620 / 0.24e2 - t3767 * t4958 * t4625 / 0.16e2 - t11572 * t4825 * t4620 … in func_pol()
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| H A D | mgga_x_scanl.c | 234 double t4620, t4626, t4627, t4637, t4640, t4645, t4654, t4683; in func_unpol() local
2330 t4620 = t2012 * t4619; in func_unpol()
4651 …04258063891829882e0 * t1084 * t12802 - 0.28131861550297056947e0 * t7698 * t4620 + 0.47631290133905… in func_unpol()
4734 …0.47287857283434471986e0 * t2517 * t2867 * t1603 * t263 - 0.84395584650891170840e0 * t9048 * t4620; in func_unpol()
5106 …t4620 + 0.59934642900653710508e0 * t3372 * t4056 * t3891 + 0.16879116930178234168e1 * t8047 * t233… in func_unpol()
5196 …86e0 * t1878 * t1591 * t645 * t1478 - 0.84395584650891170840e0 * t12504 * t4620 + 0.11378729917768… in func_unpol()
5295 …83429053584738202e0 * t4640 * t4616 + 0.33758233860356468336e1 * t13906 * t4620 + 0.67516467720712… in func_unpol()
5317 …t25629 = -0.77812782197085049260e0 * t13899 * t4620 + 0.34978477943697927495e1 * t9116 * t20381 - … in func_unpol()
5589 double t4591, t4603, t4614, t4617, t4620, t4623, t4626, t4627; in func_ferr() local
7677 t4620 = t4402 * t228; in func_ferr()
[all …]
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| H A D | mgga_c_b88.c | 166 double t4537, t4620, t4681, t4715; in func_unpol() local
1437 …t4620 = 0.74565404444444444448e-3 * t232 * t4143 - 0.11760000000000000000e-1 * t9 * t14 * t41 * (0… in func_unpol()
1440 v4sigma4[0] = rho[0] * (t4620 + t4681); in func_unpol()
2722 double t4616, t4617, t4620, t4621, t4622, t4623, t4624, t4625; in func_pol() local
6174 t4620 = t214 * t1600; in func_pol()
6175 t4621 = 0.37282702222222222226e-3 * t4620; in func_pol()
8814 …t13984 = 0.74565404444444444452e-3 * t4620 - 0.80000000000000000000e0 * t4624 + 0.3479718874074074… in func_pol()
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| H A D | mgga_x_edmgga.c | 3486 double t4616, t4620, t4651, t4654, t4658, t4665, t4666, t4668; in func_pol() local
5758 t4620 = t3590 * t279; in func_pol()
5764 …1283 + t4602 * t71 - 0.6e1 * t52 * t4613 + 0.4e1 * t52 * t4616 + 0.2e1 * t52 * t4620 - t52 * t4666; in func_pol()
7522 …183 - 0.6e1 * t3144 * t1282 * t279 * t183 - t3571 * t280 + 0.2e1 * t157 * t4620 + 0.2e1 * t52 * t1… in func_pol()
8346 … * t1260 + 0.8e1 * t1105 * t1109 - 0.12e2 * t270 * t4613 + 0.4e1 * t270 * t4620 - 0.12e2 * t315 * … in func_pol()
8587 …0 * t280 - 0.18e2 * t315 * t4613 + 0.12e2 * t315 * t4616 + 0.6e1 * t315 * t4620 - 0.3e1 * t4602 * … in func_pol()
8636 …70 * t5276 - 0.6e1 * t356 * t4613 + 0.4e1 * t356 * t4616 + 0.2e1 * t356 * t4620 + 0.2e1 * t1255 * … in func_pol()
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| H A D | mgga_x_vt84.c | 6745 double t4611, t4612, t4615, t4616, t4617, t4620, t4621, t4622; in func_pol() local
9397 t4620 = t660 * t481; in func_pol()
9398 t4621 = t4620 * t210; in func_pol()
9820 t5781 = t473 * t4620; in func_pol()
10180 t6780 = t4620 * t213; in func_pol()
12481 …971420186933674283e1 * t4261 * t4202 - 0.46986995836909788308e0 * t1227 * t4620 * t5782 - 0.469869… in func_pol()
12497 …t502 * t6027 + 0.22077777777777777776e0 * t10950 * t5791 + 0.8e1 * t208 * t4620 * t4602 - 0.4e1 * … in func_pol()
12873 t20024 = t492 * t4620; in func_pol()
13430 …16666666666666665e0 * t17067 * t4227 - 0.70480493755364682462e0 * t1620 * t4620 * t5782 + 0.12e2 *… in func_pol()
13711 …38888888888888888e0 * t18940 * t4227 - 0.23493497918454894154e0 * t1939 * t4620 * t5782 - 0.875367… in func_pol()
[all …]
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| H A D | mgga_x_rtpss.c | 155 double t4577, t4596, t4606, t4609, t4620, t4638, t4643, t4660; in func_unpol() local
1340 t4620 = t2254 * t2084; in func_unpol()
1341 …86 + 0.750e3 * t1984 + 0.225e3 * t2081 * t3799 - 0.45e2 / 0.32e2 * t159 * t4620 + 0.567e3 / 0.64e2… in func_unpol()
1408 …8e1 * t1983 * t4880 + 0.225e3 * t2081 * t4738 + 0.45e2 / 0.256e3 * t504 * t4620 + 0.567e3 / 0.64e2… in func_unpol()
1427 …t5316 = -0.45e2 / 0.8e1 * t604 * t4620 + 0.900e3 * t2081 * t4880 + 0.567e3 / 0.64e2 * t2268 * t530… in func_unpol()
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| H A D | mgga_x_tm.c | 4218 double t4612, t4620, t4627, t4634, t4637, t4638, t4642, t4645; in func_pol() local
6436 t4620 = t39 * t259 * t1095; in func_pol()
6439 …55289876543209876e-1 * t1353 * t1735 + 0.25155289876543209876e-1 * t552 * t4620 - 0.41925483127572… in func_pol()
8207 …28 * t3695 - 0.83850966255144032920e-1 * t3568 * t1735 - 0.83850966255144032920e-1 * t1361 * t4620; in func_pol()
8253 …t12697 = 0.25155289876543209876e-1 * t3558 * t1735 + 0.50310579753086419752e-1 * t1353 * t4620 + 0… in func_pol()
8814 …t16098 = 0.50310579753086419752e-1 * t4532 * t1735 + 0.50310579753086419752e-1 * t1728 * t4620 - 0… in func_pol()
9150 …0579753086419752e-1 * t5138 * t1735 + 0.50310579753086419752e-1 * t1898 * t4620 + 0.50310579753086… in func_pol()
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| H A D | mgga_xc_b98.c | 252 double t4575, t4578, t4581, t4592, t4606, t4611, t4615, t4620; in func_unpol() local
2246 t4620 = t3844 * t10; in func_unpol()
2247 …15 * t4467 + 0.89201762291358024693e-4 * t1810 * t4442 + 0.69800020468442345562e-7 * t4620 * t4467; in func_unpol()
2280 t5008 = t4620 * t5007; in func_unpol()
3258 double t4618, t4620, t4622, t4624, t4633, t4638, t4642, t4643; in func_ferr() local
4899 t4620 = t1095 * t4484; in func_ferr()
4917 …1 * t4616 + 0.79942017052008851328e0 * t4618 - 0.24558187638377119128e1 * t4620 - 0.10382772288614… in func_ferr()
5645 double t4619, t4620, t4621, t4622, t4623, t4624, t4625, t4627; in func_pol() local
9797 t4620 = 0.11658750000000000000e-1 * t4619; in func_pol()
9843 …t4718 = t4620 + t4622 - t4625 - 0.3e1 / 0.8e1 * t4627 - t4700 - t4705 - t4707 - t4709 - t4711 - t4… in func_pol()
[all …]
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| H A D | mgga_x_m06l.c | 2891 double t4609, t4612, t4613, t4614, t4617, t4620, t4647, t4648; in func_pol() local
5015 t4620 = t1402 * t2122 * t271; in func_pol()
5051 v3rhotau2[0] = -t4617 / 0.2e1 - t581 * t4620 / 0.2e1 - 0.3e1 / 0.8e1 * t581 * t4836; in func_pol()
6368 t9888 = t3457 * t4620; in func_pol()
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| /dports/science/libxc/libxc-5.0.0/src/maple2c/lda_exc/ |
| H A D | lda_c_vwn_3.c | 934 double t4607, t4608, t4612, t4613, t4617, t4618, t4620, t4622; in func_pol() local
2728 t4620 = t1269 * t403; in func_pol()
2731 …t4608 / 0.2e1 + t4612 + t4613 / 0.2e1 + t4617 + 0.48e2 * t4618 - 0.48e2 * t4620 + t4623 + t3593 + … in func_pol()
2937 … - t5109 / 0.4e1 - t112 * t380 * t2368 / 0.8e1 - t5114 / 0.8e1 - 0.24e2 * t4620 + t3593 + t3672 + … in func_pol()
3065 … t5107 / 0.2e1 - t5109 / 0.6e1 - t5114 / 0.12e2 - 0.8e1 * t4618 - 0.8e1 * t4620 + t5606 - 0.24e2 *… in func_pol()
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| H A D | lda_xc_bn05.c | 973 double t4618, t4620; in func_pol() local
2993 …t4620 = -t4019 / 0.4e1 + t4298 - t4299 - 0.3e1 / 0.32e2 * t4030 + t4301 + t4302 - t4455 + t4456 - … in func_pol()
2995 …v3rho3[3] = t11 * (t4296 + t4620) - 0.3e1 / 0.4e1 * t1416 - 0.3e1 / 0.8e1 * t1422 - 0.3e1 / 0.4e1 … in func_pol()
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