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Searched refs:v4lapltau3 (Results 1 – 25 of 71) sorted by relevance

123

/dports/science/libxc/libxc-5.0.0/src/
H A Dutil.c286 dim->v4lapl2tau2 = dim->v4lapltau3 = dim->v4tau4 =1; in internal_counters_set_mgga()
344 dim->v4lapltau3 = 2*4; in internal_counters_set_mgga()
591 *v4lapltau3 += pos*dim->v4lapltau3 + offset; in internal_counters_mgga_random()
685 *v4lapltau3 += dim->v4lapltau3 + offset; in internal_counters_mgga_next()
779 *v4lapltau3 -= dim->v4lapltau3 + offset; in internal_counters_mgga_prev()
H A Dmgga.c178 assert(v4lapltau3 != NULL); in xc_mgga()
217 libxc_memset(v4lapltau3, 0, dim->v4lapltau3 *np*sizeof(double)); in xc_mgga()
419 double *v4lapl2tau2, double *v4lapltau3, double *v4tau4) in xc_mgga_lxc() argument
433 v4lapl2tau2, v4lapltau3, v4tau4 in xc_mgga_lxc()
H A Dlibxc_master.F90622 v4lapl3tau, v4lapl2tau2, v4lapltau3, v4tau4 &
643 v4lapl3tau(*), v4lapl2tau2(*), v4lapltau3(*), v4tau4(*) local
770 v4lapl3tau, v4lapl2tau2, v4lapltau3, v4tau4 &
783 v4lapl3tau(*), v4lapl2tau2(*), v4lapltau3(*), v4tau4(*) local
1324 v4lapl3tau, v4lapl2tau2, v4lapltau3, v4tau4 & argument
1344 v4lapl3tau(*), v4lapl2tau2(*), v4lapltau3(*), v4tau4(*) local
1359 v4lapl3tau, v4lapl2tau2, v4lapltau3, v4tau4 &
1522 v4lapl3tau, v4lapl2tau2, v4lapltau3, v4tau4 & argument
1534 v4lapl3tau(*), v4lapl2tau2(*), v4lapltau3(*), v4tau4(*) local
1543 v4lapl3tau, v4lapl2tau2, v4lapltau3, v4tau4 &
H A Dxc.h111 P_ v4lapl2tau2, P_ v4lapltau3, P_ v4tau4
367 double *v4lapl2tau2, double *v4lapltau3, double *v4tau4);
H A Dmix_func.c272 v4lapltau3_ = (double *) libxc_malloc(sizeof(double)*np*dim->v4lapltau3); in xc_mix_func()
421 sum_var(v4lapltau3); in xc_mix_func()
/dports/science/elk/elk-7.2.42/src/
H A Dlibxcf90.f901217 v4lapl3tau, v4lapl2tau2, v4lapltau3, v4tau4 &
1238 v4lapl3tau(*), v4lapl2tau2(*), v4lapltau3(*), v4tau4(*) local
1365 v4lapl3tau, v4lapl2tau2, v4lapltau3, v4tau4 &
1378 v4lapl3tau(*), v4lapl2tau2(*), v4lapltau3(*), v4tau4(*) local
1971 v4lapl3tau, v4lapl2tau2, v4lapltau3, v4tau4 & argument
1991 v4lapl3tau(*), v4lapl2tau2(*), v4lapltau3(*), v4tau4(*) local
2006 v4lapl3tau, v4lapl2tau2, v4lapltau3, v4tau4 &
2169 v4lapl3tau, v4lapl2tau2, v4lapltau3, v4tau4 & argument
2181 v4lapl3tau(*), v4lapl2tau2(*), v4lapltau3(*), v4tau4(*) local
2190 v4lapl3tau, v4lapl2tau2, v4lapltau3, v4tau4 &
/dports/science/libxc/libxc-5.0.0/src/maple2c/mgga_exc/
H A Dmgga_xc_lp90.c309 v4lapltau3[0] = 0.0e0; in func_unpol()
624 v4lapltau3[0] = 0.0e0; in func_ferr()
3288 v4lapltau3[0] = 0.0e0; in func_pol()
3291 v4lapltau3[1] = 0.0e0; in func_pol()
3294 v4lapltau3[2] = 0.0e0; in func_pol()
3297 v4lapltau3[3] = 0.0e0; in func_pol()
3300 v4lapltau3[4] = 0.0e0; in func_pol()
3303 v4lapltau3[5] = 0.0e0; in func_pol()
3306 v4lapltau3[6] = 0.0e0; in func_pol()
3309 v4lapltau3[7] = 0.0e0; in func_pol()
H A Dmgga_xc_zlp.c340 v4lapltau3[0] = 0.0e0; in func_unpol()
686 v4lapltau3[0] = 0.0e0; in func_ferr()
3392 v4lapltau3[0] = 0.0e0; in func_pol()
3395 v4lapltau3[1] = 0.0e0; in func_pol()
3398 v4lapltau3[2] = 0.0e0; in func_pol()
3401 v4lapltau3[3] = 0.0e0; in func_pol()
3404 v4lapltau3[4] = 0.0e0; in func_pol()
3407 v4lapltau3[5] = 0.0e0; in func_pol()
3410 v4lapltau3[6] = 0.0e0; in func_pol()
3413 v4lapltau3[7] = 0.0e0; in func_pol()
H A Dmgga_x_gdme.c326 v4lapltau3[0] = 0.0e0; in func_unpol()
655 v4lapltau3[0] = 0.0e0; in func_ferr()
3707 v4lapltau3[0] = 0.0e0; in func_pol()
3710 v4lapltau3[1] = 0.0e0; in func_pol()
3713 v4lapltau3[2] = 0.0e0; in func_pol()
3716 v4lapltau3[3] = 0.0e0; in func_pol()
3719 v4lapltau3[4] = 0.0e0; in func_pol()
3722 v4lapltau3[5] = 0.0e0; in func_pol()
3725 v4lapltau3[6] = 0.0e0; in func_pol()
3728 v4lapltau3[7] = 0.0e0; in func_pol()
H A Dmgga_x_lta.c331 v4lapltau3[0] = 0.0e0; in func_unpol()
660 v4lapltau3[0] = 0.0e0; in func_ferr()
3727 v4lapltau3[0] = 0.0e0; in func_pol()
3730 v4lapltau3[1] = 0.0e0; in func_pol()
3733 v4lapltau3[2] = 0.0e0; in func_pol()
3736 v4lapltau3[3] = 0.0e0; in func_pol()
3739 v4lapltau3[4] = 0.0e0; in func_pol()
3742 v4lapltau3[5] = 0.0e0; in func_pol()
3745 v4lapltau3[6] = 0.0e0; in func_pol()
3748 v4lapltau3[7] = 0.0e0; in func_pol()
H A Dmgga_x_rlda.c429 v4lapltau3[0] = -0.3e1 / 0.16e2 * t40 * t41 * t522; in func_unpol()
857 v4lapltau3[0] = -0.3e1 / 0.8e1 * t34 * t35 * t504; in func_ferr()
4044 v4lapltau3[0] = -0.3e1 / 0.8e1 * t145 * t146 * t3429; in func_pol()
4047 v4lapltau3[1] = 0.0e0; in func_pol()
4050 v4lapltau3[2] = 0.0e0; in func_pol()
4053 v4lapltau3[3] = 0.0e0; in func_pol()
4056 v4lapltau3[4] = 0.0e0; in func_pol()
4059 v4lapltau3[5] = 0.0e0; in func_pol()
4062 v4lapltau3[6] = 0.0e0; in func_pol()
4066 v4lapltau3[7] = -0.3e1 / 0.8e1 * t145 * t155 * t3434; in func_pol()
H A Dmgga_c_cs.c354 v4lapltau3[0] = 0.0e0; in func_unpol()
608 v4lapltau3[0] = 0.0e0; in func_ferr()
4325 v4lapltau3[0] = 0.0e0; in func_pol()
4328 v4lapltau3[1] = 0.0e0; in func_pol()
4331 v4lapltau3[2] = 0.0e0; in func_pol()
4334 v4lapltau3[3] = 0.0e0; in func_pol()
4337 v4lapltau3[4] = 0.0e0; in func_pol()
4340 v4lapltau3[5] = 0.0e0; in func_pol()
4343 v4lapltau3[6] = 0.0e0; in func_pol()
4346 v4lapltau3[7] = 0.0e0; in func_pol()
H A Dmgga_x_2d_js17.c419 v4lapltau3[0] = 0.0e0; in func_unpol()
833 v4lapltau3[0] = 0.0e0; in func_ferr()
4108 v4lapltau3[0] = 0.0e0; in func_pol()
4111 v4lapltau3[1] = 0.0e0; in func_pol()
4114 v4lapltau3[2] = 0.0e0; in func_pol()
4117 v4lapltau3[3] = 0.0e0; in func_pol()
4120 v4lapltau3[4] = 0.0e0; in func_pol()
4123 v4lapltau3[5] = 0.0e0; in func_pol()
4126 v4lapltau3[6] = 0.0e0; in func_pol()
4129 v4lapltau3[7] = 0.0e0; in func_pol()
H A Dmgga_x_gvt4.c609 v4lapltau3[0] = 0.0e0; in func_unpol()
1199 v4lapltau3[0] = 0.0e0; in func_ferr()
4709 v4lapltau3[0] = 0.0e0; in func_pol()
4712 v4lapltau3[1] = 0.0e0; in func_pol()
4715 v4lapltau3[2] = 0.0e0; in func_pol()
4718 v4lapltau3[3] = 0.0e0; in func_pol()
4721 v4lapltau3[4] = 0.0e0; in func_pol()
4724 v4lapltau3[5] = 0.0e0; in func_pol()
4727 v4lapltau3[6] = 0.0e0; in func_pol()
4730 v4lapltau3[7] = 0.0e0; in func_pol()
H A Dmgga_x_pkzb.c500 v4lapltau3[0] = 0.0e0; in func_unpol()
989 v4lapltau3[0] = 0.0e0; in func_ferr()
4666 v4lapltau3[0] = 0.0e0; in func_pol()
4669 v4lapltau3[1] = 0.0e0; in func_pol()
4672 v4lapltau3[2] = 0.0e0; in func_pol()
4675 v4lapltau3[3] = 0.0e0; in func_pol()
4678 v4lapltau3[4] = 0.0e0; in func_pol()
4681 v4lapltau3[5] = 0.0e0; in func_pol()
4684 v4lapltau3[6] = 0.0e0; in func_pol()
4687 v4lapltau3[7] = 0.0e0; in func_pol()
H A Dhyb_mgga_x_dldf.c523 v4lapltau3[0] = 0.0e0; in func_unpol()
1015 v4lapltau3[0] = 0.0e0; in func_ferr()
4904 v4lapltau3[0] = 0.0e0; in func_pol()
4907 v4lapltau3[1] = 0.0e0; in func_pol()
4910 v4lapltau3[2] = 0.0e0; in func_pol()
4913 v4lapltau3[3] = 0.0e0; in func_pol()
4916 v4lapltau3[4] = 0.0e0; in func_pol()
4919 v4lapltau3[5] = 0.0e0; in func_pol()
4922 v4lapltau3[6] = 0.0e0; in func_pol()
4925 v4lapltau3[7] = 0.0e0; in func_pol()
H A Dmgga_xc_cc06.c462 v4lapltau3[0] = 0.0e0; in func_unpol()
927 v4lapltau3[0] = 0.0e0; in func_ferr()
4796 v4lapltau3[0] = 0.0e0; in func_pol()
4799 v4lapltau3[1] = 0.0e0; in func_pol()
4802 v4lapltau3[2] = 0.0e0; in func_pol()
4805 v4lapltau3[3] = 0.0e0; in func_pol()
4808 v4lapltau3[4] = 0.0e0; in func_pol()
4811 v4lapltau3[5] = 0.0e0; in func_pol()
4814 v4lapltau3[6] = 0.0e0; in func_pol()
4817 v4lapltau3[7] = 0.0e0; in func_pol()
H A Dmgga_x_tau_hcth.c636 v4lapltau3[0] = 0.0e0; in func_unpol()
1262 v4lapltau3[0] = 0.0e0; in func_ferr()
4909 v4lapltau3[0] = 0.0e0; in func_pol()
4912 v4lapltau3[1] = 0.0e0; in func_pol()
4915 v4lapltau3[2] = 0.0e0; in func_pol()
4918 v4lapltau3[3] = 0.0e0; in func_pol()
4921 v4lapltau3[4] = 0.0e0; in func_pol()
4924 v4lapltau3[5] = 0.0e0; in func_pol()
4927 v4lapltau3[6] = 0.0e0; in func_pol()
4930 v4lapltau3[7] = 0.0e0; in func_pol()
H A Dmgga_x_gx.c1189 v4lapltau3[0] = 0.0e0; in func_unpol()
2246 v4lapltau3[0] = 0.0e0; in func_ferr()
6695 v4lapltau3[0] = 0.0e0; in func_pol()
6698 v4lapltau3[1] = 0.0e0; in func_pol()
6701 v4lapltau3[2] = 0.0e0; in func_pol()
6704 v4lapltau3[3] = 0.0e0; in func_pol()
6707 v4lapltau3[4] = 0.0e0; in func_pol()
6710 v4lapltau3[5] = 0.0e0; in func_pol()
6713 v4lapltau3[6] = 0.0e0; in func_pol()
6716 v4lapltau3[7] = 0.0e0; in func_pol()
H A Dhyb_mgga_x_m05.c996 v4lapltau3[0] = 0.0e0; in func_unpol()
2038 v4lapltau3[0] = 0.0e0; in func_ferr()
6978 v4lapltau3[0] = 0.0e0; in func_pol()
6981 v4lapltau3[1] = 0.0e0; in func_pol()
6984 v4lapltau3[2] = 0.0e0; in func_pol()
6987 v4lapltau3[3] = 0.0e0; in func_pol()
6990 v4lapltau3[4] = 0.0e0; in func_pol()
6993 v4lapltau3[5] = 0.0e0; in func_pol()
6996 v4lapltau3[6] = 0.0e0; in func_pol()
6999 v4lapltau3[7] = 0.0e0; in func_pol()
H A Dmgga_x_mvs.c916 v4lapltau3[0] = 0.0e0; in func_unpol()
1788 v4lapltau3[0] = 0.0e0; in func_ferr()
6937 v4lapltau3[0] = 0.0e0; in func_pol()
6940 v4lapltau3[1] = 0.0e0; in func_pol()
6943 v4lapltau3[2] = 0.0e0; in func_pol()
6946 v4lapltau3[3] = 0.0e0; in func_pol()
6949 v4lapltau3[4] = 0.0e0; in func_pol()
6952 v4lapltau3[5] = 0.0e0; in func_pol()
6955 v4lapltau3[6] = 0.0e0; in func_pol()
6958 v4lapltau3[7] = 0.0e0; in func_pol()
H A Dmgga_x_pbe_gx.c1240 v4lapltau3[0] = 0.0e0; in func_unpol()
2350 v4lapltau3[0] = 0.0e0; in func_ferr()
7828 v4lapltau3[0] = 0.0e0; in func_pol()
7831 v4lapltau3[1] = 0.0e0; in func_pol()
7834 v4lapltau3[2] = 0.0e0; in func_pol()
7837 v4lapltau3[3] = 0.0e0; in func_pol()
7840 v4lapltau3[4] = 0.0e0; in func_pol()
7843 v4lapltau3[5] = 0.0e0; in func_pol()
7846 v4lapltau3[6] = 0.0e0; in func_pol()
7849 v4lapltau3[7] = 0.0e0; in func_pol()
H A Dmgga_x_m06l.c1307 v4lapltau3[0] = 0.0e0; in func_unpol()
2643 v4lapltau3[0] = 0.0e0; in func_ferr()
7637 v4lapltau3[0] = 0.0e0; in func_pol()
7640 v4lapltau3[1] = 0.0e0; in func_pol()
7643 v4lapltau3[2] = 0.0e0; in func_pol()
7646 v4lapltau3[3] = 0.0e0; in func_pol()
7649 v4lapltau3[4] = 0.0e0; in func_pol()
7652 v4lapltau3[5] = 0.0e0; in func_pol()
7655 v4lapltau3[6] = 0.0e0; in func_pol()
7658 v4lapltau3[7] = 0.0e0; in func_pol()
H A Dmgga_x_mvsb.c1110 v4lapltau3[0] = 0.0e0; in func_unpol()
2198 v4lapltau3[0] = 0.0e0; in func_ferr()
7793 v4lapltau3[0] = 0.0e0; in func_pol()
7796 v4lapltau3[1] = 0.0e0; in func_pol()
7799 v4lapltau3[2] = 0.0e0; in func_pol()
7802 v4lapltau3[3] = 0.0e0; in func_pol()
7805 v4lapltau3[4] = 0.0e0; in func_pol()
7808 v4lapltau3[5] = 0.0e0; in func_pol()
7811 v4lapltau3[6] = 0.0e0; in func_pol()
7814 v4lapltau3[7] = 0.0e0; in func_pol()
H A Dmgga_x_ms.c1355 v4lapltau3[0] = 0.0e0; in func_unpol()
2639 v4lapltau3[0] = 0.0e0; in func_ferr()
7569 v4lapltau3[0] = 0.0e0; in func_pol()
7572 v4lapltau3[1] = 0.0e0; in func_pol()
7575 v4lapltau3[2] = 0.0e0; in func_pol()
7578 v4lapltau3[3] = 0.0e0; in func_pol()
7581 v4lapltau3[4] = 0.0e0; in func_pol()
7584 v4lapltau3[5] = 0.0e0; in func_pol()
7587 v4lapltau3[6] = 0.0e0; in func_pol()
7590 v4lapltau3[7] = 0.0e0; in func_pol()

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