/dports/science/libxc/libxc-5.0.0/src/ |
H A D | util.c | 282 dim->v4rholapl3 = dim->v4rholapl2tau = dim->v4rholapltau2 = dim->v4rhotau3 = 1; in internal_counters_set_mgga() 331 dim->v4rhotau3 = 2*4; in internal_counters_set_mgga() 598 *v4rhotau3 += pos*dim->v4rhotau3 + offset; in internal_counters_mgga_random() 692 *v4rhotau3 += dim->v4rhotau3 + offset; in internal_counters_mgga_next() 786 *v4rhotau3 -= dim->v4rhotau3 + offset; in internal_counters_mgga_prev()
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H A D | mgga.c | 151 assert(v4rhotau3 != NULL); in xc_mgga() 190 libxc_memset(v4rhotau3, 0, dim->v4rhotau3 *np*sizeof(double)); in xc_mgga() 415 … double *v4rholapl3, double *v4rholapl2tau, double *v4rholapltau2, double *v4rhotau3, in xc_mgga_lxc() argument 429 v4rholapl3, v4rholapl2tau, v4rholapltau2, v4rhotau3, in xc_mgga_lxc()
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H A D | libxc_master.F90 | 619 v4rhosigmatau2, v4rholapl3, v4rholapl2tau, v4rholapltau2, v4rhotau3, v4sigma4, & 640 … v4rhosigmatau2(*), v4rholapl3(*), v4rholapl2tau(*), v4rholapltau2(*), v4rhotau3(*), v4sigma4(*), & local 767 v4rhosigmatau2, v4rholapl3, v4rholapl2tau, v4rholapltau2, v4rhotau3, v4sigma4, & 780 … v4rhosigmatau2(*), v4rholapl3(*), v4rholapl2tau(*), v4rholapltau2(*), v4rhotau3(*), v4sigma4(*), & local 1321 v4rhosigmatau2, v4rholapl3, v4rholapl2tau, v4rholapltau2, v4rhotau3, v4sigma4, & argument 1341 … v4rhosigmatau2(*), v4rholapl3(*), v4rholapl2tau(*), v4rholapltau2(*), v4rhotau3(*), v4sigma4(*), & local 1356 v4rhosigmatau2, v4rholapl3, v4rholapl2tau, v4rholapltau2, v4rhotau3, v4sigma4, & 1519 v4rhosigmatau2, v4rholapl3, v4rholapl2tau, v4rholapltau2, v4rhotau3, v4sigma4, & argument 1531 … v4rhosigmatau2(*), v4rholapl3(*), v4rholapl2tau(*), v4rholapltau2(*), v4rhotau3(*), v4sigma4(*), & local 1540 v4rhosigmatau2, v4rholapl3, v4rholapl2tau, v4rholapltau2, v4rhotau3, v4sigma4, &
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H A D | xc.h | 107 P_ v4rholapl3, P_ v4rholapl2tau, P_ v4rholapltau2, P_ v4rhotau3, \ 363 double *v4rholapl3, double *v4rholapl2tau, double *v4rholapltau2, double *v4rhotau3,
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H A D | mix_func.c | 259 v4rhotau3_ = (double *) libxc_malloc(sizeof(double)*np*dim->v4rhotau3); in xc_mix_func() 428 sum_var(v4rhotau3); in xc_mix_func()
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/dports/science/elk/elk-7.2.42/src/ |
H A D | libxcf90.f90 | 1214 v4rhosigmatau2, v4rholapl3, v4rholapl2tau, v4rholapltau2, v4rhotau3, v4sigma4, & 1235 … v4rhosigmatau2(*), v4rholapl3(*), v4rholapl2tau(*), v4rholapltau2(*), v4rhotau3(*), v4sigma4(*), & local 1362 v4rhosigmatau2, v4rholapl3, v4rholapl2tau, v4rholapltau2, v4rhotau3, v4sigma4, & 1375 … v4rhosigmatau2(*), v4rholapl3(*), v4rholapl2tau(*), v4rholapltau2(*), v4rhotau3(*), v4sigma4(*), & local 1968 v4rhosigmatau2, v4rholapl3, v4rholapl2tau, v4rholapltau2, v4rhotau3, v4sigma4, & argument 1988 … v4rhosigmatau2(*), v4rholapl3(*), v4rholapl2tau(*), v4rholapltau2(*), v4rhotau3(*), v4sigma4(*), & local 2003 v4rhosigmatau2, v4rholapl3, v4rholapl2tau, v4rholapltau2, v4rhotau3, v4sigma4, & 2166 v4rhosigmatau2, v4rholapl3, v4rholapl2tau, v4rholapltau2, v4rhotau3, v4sigma4, & argument 2178 … v4rhosigmatau2(*), v4rholapl3(*), v4rholapl2tau(*), v4rholapltau2(*), v4rhotau3(*), v4sigma4(*), & local 2187 v4rhosigmatau2, v4rholapl3, v4rholapl2tau, v4rholapltau2, v4rhotau3, v4sigma4, &
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/dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/ |
H A D | mgga_xc_lp90.c | 267 v4rhotau3[0] = 0.0e0; in func_unpol() 582 v4rhotau3[0] = 0.0e0; in func_ferr() 2673 v4rhotau3[0] = 0.0e0; in func_pol() 2676 v4rhotau3[1] = 0.0e0; in func_pol() 2679 v4rhotau3[2] = 0.0e0; in func_pol() 2682 v4rhotau3[3] = 0.0e0; in func_pol() 2685 v4rhotau3[4] = 0.0e0; in func_pol() 2688 v4rhotau3[5] = 0.0e0; in func_pol() 2691 v4rhotau3[6] = 0.0e0; in func_pol() 2694 v4rhotau3[7] = 0.0e0; in func_pol()
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H A D | mgga_xc_zlp.c | 298 v4rhotau3[0] = 0.0e0; in func_unpol() 644 v4rhotau3[0] = 0.0e0; in func_ferr() 2777 v4rhotau3[0] = 0.0e0; in func_pol() 2780 v4rhotau3[1] = 0.0e0; in func_pol() 2783 v4rhotau3[2] = 0.0e0; in func_pol() 2786 v4rhotau3[3] = 0.0e0; in func_pol() 2789 v4rhotau3[4] = 0.0e0; in func_pol() 2792 v4rhotau3[5] = 0.0e0; in func_pol() 2795 v4rhotau3[6] = 0.0e0; in func_pol() 2798 v4rhotau3[7] = 0.0e0; in func_pol()
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H A D | mgga_x_gdme.c | 284 v4rhotau3[0] = 0.0e0; in func_unpol() 613 v4rhotau3[0] = 0.0e0; in func_ferr() 3092 v4rhotau3[0] = 0.0e0; in func_pol() 3095 v4rhotau3[1] = 0.0e0; in func_pol() 3098 v4rhotau3[2] = 0.0e0; in func_pol() 3101 v4rhotau3[3] = 0.0e0; in func_pol() 3104 v4rhotau3[4] = 0.0e0; in func_pol() 3107 v4rhotau3[5] = 0.0e0; in func_pol() 3110 v4rhotau3[6] = 0.0e0; in func_pol() 3113 v4rhotau3[7] = 0.0e0; in func_pol()
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H A D | mgga_x_lta.c | 289 …v4rhotau3[0] = -0.19e2 / 0.16e2 * t63 * t116 + 0.5e1 / 0.16e2 * t63 * t42 * t145 * t114 + 0.11e2 /… in func_unpol() 618 …v4rhotau3[0] = -0.19e2 / 0.8e1 * t28 * t108 + 0.5e1 / 0.8e1 * t28 * t29 * t138 * t106 + 0.11e2 / 0… in func_ferr() 3109 …v4rhotau3[0] = -t2680 - t113 * t291 * t954 * t58 / 0.2e1 + 0.5e1 / 0.8e1 * t113 * t114 * t1025 * t… in func_pol() 3112 v4rhotau3[1] = 0.0e0; in func_pol() 3115 v4rhotau3[2] = 0.0e0; in func_pol() 3121 …v4rhotau3[3] = -t2709 - t113 * t303 * t968 * t78 / 0.2e1 + t2715 + 0.3e1 / 0.2e1 * t113 * t303 * t… in func_pol() 3124 …v4rhotau3[4] = -t2680 - t113 * t291 * t954 * t90 / 0.2e1 + t2691 + 0.3e1 / 0.2e1 * t113 * t291 * t… in func_pol() 3127 v4rhotau3[5] = 0.0e0; in func_pol() 3130 v4rhotau3[6] = 0.0e0; in func_pol() 3133 …v4rhotau3[7] = -t2709 - t113 * t303 * t968 * t95 / 0.2e1 + 0.5e1 / 0.8e1 * t113 * t120 * t1025 * t… in func_pol()
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H A D | mgga_x_rlda.c | 382 v4rhotau3[0] = -t109 * t290 / 0.4e1 - 0.3e1 / 0.16e2 * t40 * t41 * t497; in func_unpol() 810 v4rhotau3[0] = -t98 * t279 / 0.2e1 - 0.3e1 / 0.8e1 * t34 * t35 * t479; in func_ferr() 3418 …v4rhotau3[0] = -t3354 / 0.2e1 - t145 * t360 * t1302 * t71 / 0.2e1 - 0.3e1 / 0.8e1 * t145 * t146 * … in func_pol() 3421 v4rhotau3[1] = 0.0e0; in func_pol() 3424 v4rhotau3[2] = 0.0e0; in func_pol() 3428 v4rhotau3[3] = -t145 * t383 * t1307 * t101 / 0.2e1 - t3367 / 0.2e1; in func_pol() 3431 v4rhotau3[4] = -t145 * t360 * t1302 * t113 / 0.2e1 - t3354 / 0.2e1; in func_pol() 3434 v4rhotau3[5] = 0.0e0; in func_pol() 3437 v4rhotau3[6] = 0.0e0; in func_pol() 3441 …v4rhotau3[7] = -t3367 / 0.2e1 - t145 * t383 * t1307 * t118 / 0.2e1 - 0.3e1 / 0.8e1 * t145 * t155 *… in func_pol()
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H A D | mgga_c_cs.c | 312 v4rhotau3[0] = 0.0e0; in func_unpol() 566 v4rhotau3[0] = 0.0e0; in func_ferr() 3710 v4rhotau3[0] = 0.0e0; in func_pol() 3713 v4rhotau3[1] = 0.0e0; in func_pol() 3716 v4rhotau3[2] = 0.0e0; in func_pol() 3719 v4rhotau3[3] = 0.0e0; in func_pol() 3722 v4rhotau3[4] = 0.0e0; in func_pol() 3725 v4rhotau3[5] = 0.0e0; in func_pol() 3728 v4rhotau3[6] = 0.0e0; in func_pol() 3731 v4rhotau3[7] = 0.0e0; in func_pol()
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H A D | mgga_x_2d_js17.c | 375 v4rhotau3[0] = 0.0e0; in func_unpol() 789 v4rhotau3[0] = 0.0e0; in func_ferr() 3489 v4rhotau3[0] = 0.0e0; in func_pol() 3492 v4rhotau3[1] = 0.0e0; in func_pol() 3495 v4rhotau3[2] = 0.0e0; in func_pol() 3498 v4rhotau3[3] = 0.0e0; in func_pol() 3501 v4rhotau3[4] = 0.0e0; in func_pol() 3504 v4rhotau3[5] = 0.0e0; in func_pol() 3507 v4rhotau3[6] = 0.0e0; in func_pol() 3510 v4rhotau3[7] = 0.0e0; in func_pol()
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H A D | mgga_x_gvt4.c | 559 v4rhotau3[0] = 0.2e1 / 0.3e1 * t5 * t636 + t59 * t1262 / 0.2e1; in func_unpol() 1153 v4rhotau3[0] = 0.4e1 / 0.3e1 * t2 * t583 + t50 * t1184; in func_ferr() 4083 v4rhotau3[0] = 0.4e1 / 0.3e1 * t4341 + 0.4e1 / 0.3e1 * t493 * t1766 * t109 + t218 * t4366; in func_pol() 4086 v4rhotau3[1] = 0.0e0; in func_pol() 4089 v4rhotau3[2] = 0.0e0; in func_pol() 4093 v4rhotau3[3] = 0.4e1 / 0.3e1 * t528 * t1776 * t158 + 0.4e1 / 0.3e1 * t4368; in func_pol() 4096 v4rhotau3[4] = 0.4e1 / 0.3e1 * t493 * t1766 * t168 + 0.4e1 / 0.3e1 * t4341; in func_pol() 4099 v4rhotau3[5] = 0.0e0; in func_pol() 4102 v4rhotau3[6] = 0.0e0; in func_pol() 4107 v4rhotau3[7] = 0.4e1 / 0.3e1 * t4368 + 0.4e1 / 0.3e1 * t528 * t1776 * t172 + t231 * t4399; in func_pol()
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H A D | mgga_x_pkzb.c | 452 …v4rhotau3[0] = -0.96962400000000000000e0 * t177 * t460 + 0.29088720000000000000e1 * t181 * t601 * … in func_unpol() 941 …v4rhotau3[0] = -0.19392480000000000000e1 * t166 * t434 + 0.58177440000000000000e1 * t59 * t466 * t… in func_ferr() 4041 …v4rhotau3[0] = -t5246 - 0.19392480000000000000e1 * t498 * t3081 * t1792 * t114 + 0.581774400000000… in func_pol() 4044 v4rhotau3[1] = 0.0e0; in func_pol() 4047 v4rhotau3[2] = 0.0e0; in func_pol() 4052 …v4rhotau3[3] = -t5272 - 0.19392480000000000000e1 * t498 * t3389 * t1800 * t158 + t5278 + 0.1747717… in func_pol() 4055 …v4rhotau3[4] = -t5246 - 0.19392480000000000000e1 * t498 * t3081 * t1792 * t170 + t5260 + 0.1747717… in func_pol() 4058 v4rhotau3[5] = 0.0e0; in func_pol() 4061 v4rhotau3[6] = 0.0e0; in func_pol() 4064 …v4rhotau3[7] = -t5272 - 0.19392480000000000000e1 * t498 * t3389 * t1800 * t175 + 0.581774400000000… in func_pol()
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H A D | hyb_mgga_x_dldf.c | 481 …v4rhotau3[0] = -0.96396775000000000000e-1 * t223 * t545 + 0.13448806503338709277e0 * t69 * t72 * t… in func_unpol() 973 …v4rhotau3[0] = -0.19279355000000000000e0 * t206 * t513 + 0.13448806503338709277e0 * t63 * t66 * t6… in func_ferr() 4286 …v4rhotau3[0] = -t6000 - 0.19279355000000000000e0 * t644 * t645 * t2164 * t120 + 0.1344880650333870… in func_pol() 4289 v4rhotau3[1] = 0.0e0; in func_pol() 4292 v4rhotau3[2] = 0.0e0; in func_pol() 4296 v4rhotau3[3] = -t6038 - 0.19279355000000000000e0 * t644 * t686 * t2180 * t171; in func_pol() 4299 v4rhotau3[4] = -t6000 - 0.19279355000000000000e0 * t644 * t645 * t2164 * t183; in func_pol() 4302 v4rhotau3[5] = 0.0e0; in func_pol() 4305 v4rhotau3[6] = 0.0e0; in func_pol() 4310 …v4rhotau3[7] = -t6038 - 0.19279355000000000000e0 * t644 * t686 * t2180 * t188 + 0.1344880650333870… in func_pol()
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H A D | mgga_xc_cc06.c | 419 v4rhotau3[0] = 0.0e0; in func_unpol() 884 v4rhotau3[0] = 0.0e0; in func_ferr() 4177 v4rhotau3[0] = 0.0e0; in func_pol() 4180 v4rhotau3[1] = 0.0e0; in func_pol() 4183 v4rhotau3[2] = 0.0e0; in func_pol() 4186 v4rhotau3[3] = 0.0e0; in func_pol() 4189 v4rhotau3[4] = 0.0e0; in func_pol() 4192 v4rhotau3[5] = 0.0e0; in func_pol() 4195 v4rhotau3[6] = 0.0e0; in func_pol() 4198 v4rhotau3[7] = 0.0e0; in func_pol()
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H A D | mgga_x_tau_hcth.c | 592 …v4rhotau3[0] = -t367 * t997 / 0.4e1 - 0.3e1 / 0.16e2 * t103 * t104 * t156 * t995 - 0.3e1 / 0.16e2 … in func_unpol() 1219 …v4rhotau3[0] = -t399 * t958 / 0.2e1 - 0.3e1 / 0.8e1 * t215 * t402 * t957 - 0.3e1 / 0.8e1 * t215 * … in func_ferr() 4288 …v4rhotau3[0] = -t5659 / 0.2e1 - t969 * t970 * t2673 * t183 / 0.2e1 - 0.3e1 / 0.8e1 * t377 * t378 *… in func_pol() 4291 v4rhotau3[1] = 0.0e0; in func_pol() 4294 v4rhotau3[2] = 0.0e0; in func_pol() 4298 v4rhotau3[3] = -t969 * t1014 * t2691 * t273 / 0.2e1 - t5701 / 0.2e1; in func_pol() 4301 v4rhotau3[4] = -t969 * t970 * t2673 * t285 / 0.2e1 - t5659 / 0.2e1; in func_pol() 4304 v4rhotau3[5] = 0.0e0; in func_pol() 4307 v4rhotau3[6] = 0.0e0; in func_pol() 4313 …v4rhotau3[7] = -t5701 / 0.2e1 - t969 * t1014 * t2691 * t290 / 0.2e1 - 0.3e1 / 0.8e1 * t377 * t419 … in func_pol()
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H A D | mgga_x_gx.c | 1109 v4rhotau3[0] = -t297 * t1389 / 0.4e1 - 0.3e1 / 0.16e2 * t73 * t74 * (t2918 + t2888); in func_unpol() 2193 v4rhotau3[0] = -t278 * t1309 / 0.2e1 - 0.3e1 / 0.8e1 * t68 * t69 * (t2788 + t2758); in func_ferr() 6052 …v4rhotau3[0] = -t7820 / 0.2e1 - t275 * t703 * t3302 * t130 / 0.2e1 - 0.3e1 / 0.8e1 * t275 * t276 *… in func_pol() 6055 v4rhotau3[1] = 0.0e0; in func_pol() 6058 v4rhotau3[2] = 0.0e0; in func_pol() 6062 v4rhotau3[3] = -t275 * t781 * t3345 * t197 / 0.2e1 - t7900 / 0.2e1; in func_pol() 6065 v4rhotau3[4] = -t275 * t703 * t3302 * t209 / 0.2e1 - t7820 / 0.2e1; in func_pol() 6068 v4rhotau3[5] = 0.0e0; in func_pol() 6071 v4rhotau3[6] = 0.0e0; in func_pol() 6079 …v4rhotau3[7] = -t7900 / 0.2e1 - t275 * t781 * t3345 * t214 / 0.2e1 - 0.3e1 / 0.8e1 * t275 * t305 *… in func_pol()
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H A D | hyb_mgga_x_m05.c | 954 …v4rhotau3[0] = -t526 * t1714 / 0.4e1 + 0.59124162764395035716e-2 * t117 * t121 * t122 * t1712 - 0.… in func_unpol() 1996 …v4rhotau3[0] = -t505 * t1727 / 0.2e1 + 0.59124162764395035716e-2 * t112 * t115 * t116 * t1725 - 0.… in func_ferr() 6342 …v4rhotau3[0] = -t10267 / 0.2e1 - t466 * t1230 * t4457 * t204 / 0.2e1 + 0.59124162764395035716e-2 *… in func_pol() 6345 v4rhotau3[1] = 0.0e0; in func_pol() 6348 v4rhotau3[2] = 0.0e0; in func_pol() 6352 v4rhotau3[3] = -t466 * t1399 * t4563 * t320 / 0.2e1 - t10506 / 0.2e1; in func_pol() 6355 v4rhotau3[4] = -t466 * t1230 * t4457 * t331 / 0.2e1 - t10267 / 0.2e1; in func_pol() 6358 v4rhotau3[5] = 0.0e0; in func_pol() 6361 v4rhotau3[6] = 0.0e0; in func_pol() 6384 …v4rhotau3[7] = -t10506 / 0.2e1 - t466 * t1399 * t4563 * t336 / 0.2e1 + 0.59124162764395035716e-2 *… in func_pol()
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H A D | mgga_x_mvs.c | 856 …v4rhotau3[0] = -t263 * t1103 / 0.4e1 - 0.3e1 / 0.16e2 * t79 * t80 * t2348 * t71 - t116 * t2353 * t… in func_unpol() 1736 …v4rhotau3[0] = -t249 * t1068 / 0.2e1 - 0.3e1 / 0.8e1 * t73 * t7 * t2298 * t66 - t109 * t2303 * t11… in func_ferr() 6294 …v4rhotau3[0] = -t9469 / 0.2e1 - t856 * t9471 * t141 / 0.2e1 - 0.3e1 / 0.8e1 * t321 * t322 * t9525 … in func_pol() 6297 v4rhotau3[1] = 0.0e0; in func_pol() 6300 v4rhotau3[2] = 0.0e0; in func_pol() 6305 v4rhotau3[3] = -t856 * t9535 * t202 / 0.2e1 - t9534 / 0.2e1; in func_pol() 6308 v4rhotau3[4] = -t856 * t9471 * t214 / 0.2e1 - t9469 / 0.2e1; in func_pol() 6311 v4rhotau3[5] = 0.0e0; in func_pol() 6314 v4rhotau3[6] = 0.0e0; in func_pol() 6325 …v4rhotau3[7] = -t9534 / 0.2e1 - t856 * t9535 * t219 / 0.2e1 - 0.3e1 / 0.8e1 * t321 * t341 * t9596 … in func_pol()
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H A D | mgga_x_pbe_gx.c | 1170 …v4rhotau3[0] = -t325 * t1558 / 0.4e1 - 0.3e1 / 0.16e2 * t70 * t71 * (t3315 + t3286) * t62 - 0.1015… in func_unpol() 2305 …v4rhotau3[0] = -t304 * t1443 / 0.2e1 - 0.3e1 / 0.8e1 * t66 * t7 * (t3125 + t3096) * t59 - 0.101554… in func_ferr() 7191 …v4rhotau3[0] = -t11219 / 0.2e1 - t1000 * t11221 * t130 / 0.2e1 - 0.3e1 / 0.8e1 * t358 * t193 * (t1… in func_pol() 7194 v4rhotau3[1] = 0.0e0; in func_pol() 7197 v4rhotau3[2] = 0.0e0; in func_pol() 7202 v4rhotau3[3] = -t1000 * t11304 * t206 / 0.2e1 - t11303 / 0.2e1; in func_pol() 7205 v4rhotau3[4] = -t1000 * t11221 * t218 / 0.2e1 - t11219 / 0.2e1; in func_pol() 7208 v4rhotau3[5] = 0.0e0; in func_pol() 7211 v4rhotau3[6] = 0.0e0; in func_pol() 7220 …v4rhotau3[7] = -t11303 / 0.2e1 - t1000 * t11304 * t223 / 0.2e1 - 0.3e1 / 0.8e1 * t358 * t277 * (t1… in func_pol()
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H A D | mgga_x_m06l.c | 1261 v4rhotau3[0] = -t664 * t2384 / 0.4e1 - 0.3e1 / 0.16e2 * t155 * t156 * t4597; in func_unpol() 2600 v4rhotau3[0] = -t632 * t2371 / 0.2e1 - 0.3e1 / 0.8e1 * t146 * t147 * t4611; in func_ferr() 6998 …v4rhotau3[0] = -t11090 / 0.2e1 - t581 * t1402 * t5344 * t271 / 0.2e1 - 0.3e1 / 0.8e1 * t581 * t582… in func_pol() 7001 v4rhotau3[1] = 0.0e0; in func_pol() 7004 v4rhotau3[2] = 0.0e0; in func_pol() 7008 v4rhotau3[3] = -t581 * t1460 * t5465 * t419 / 0.2e1 - t11351 / 0.2e1; in func_pol() 7011 v4rhotau3[4] = -t581 * t1402 * t5344 * t431 / 0.2e1 - t11090 / 0.2e1; in func_pol() 7014 v4rhotau3[5] = 0.0e0; in func_pol() 7017 v4rhotau3[6] = 0.0e0; in func_pol() 7041 …v4rhotau3[7] = -t11351 / 0.2e1 - t581 * t1460 * t5465 * t436 / 0.2e1 - 0.3e1 / 0.8e1 * t581 * t606… in func_pol()
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H A D | mgga_x_mvsb.c | 1056 …v4rhotau3[0] = -t321 * t1597 / 0.4e1 - 0.3e1 / 0.16e2 * t77 * t78 * (params->k0 * (0.24e2 * t110 *… in func_unpol() 2148 …v4rhotau3[0] = -t310 * t1576 / 0.2e1 - 0.3e1 / 0.8e1 * t71 * t7 * (params->k0 * (0.40e2 * t1611 * … in func_ferr() 7146 …v4rhotau3[0] = -t11933 / 0.2e1 - t1002 * t11935 * t141 / 0.2e1 - 0.3e1 / 0.8e1 * t356 * t357 * (pa… in func_pol() 7149 v4rhotau3[1] = 0.0e0; in func_pol() 7152 v4rhotau3[2] = 0.0e0; in func_pol() 7157 v4rhotau3[3] = -t1002 * t12074 * t218 / 0.2e1 - t12073 / 0.2e1; in func_pol() 7160 v4rhotau3[4] = -t1002 * t11935 * t230 / 0.2e1 - t11933 / 0.2e1; in func_pol() 7163 v4rhotau3[5] = 0.0e0; in func_pol() 7166 v4rhotau3[6] = 0.0e0; in func_pol() 7183 …v4rhotau3[7] = -t12073 / 0.2e1 - t1002 * t12074 * t235 / 0.2e1 - 0.3e1 / 0.8e1 * t356 * t386 * (pa… in func_pol()
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/dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_vxc/ |
H A D | mgga_x_2d_prp10.c | 613 v4rhotau3[0] = -t1546 * t31 * t33 / 0.2e1; in func_unpol() 1220 v4rhotau3[0] = -t1462 * t30; in func_ferr() 3290 v4rhotau3[0] = -t2879 * t30; in func_pol() 3293 v4rhotau3[1] = 0.0e0; in func_pol() 3296 v4rhotau3[2] = 0.0e0; in func_pol() 3299 v4rhotau3[3] = 0.0e0; in func_pol() 3302 v4rhotau3[4] = 0.0e0; in func_pol() 3305 v4rhotau3[5] = 0.0e0; in func_pol() 3308 v4rhotau3[6] = 0.0e0; in func_pol() 3315 v4rhotau3[7] = -t2920 * t58; in func_pol()
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