From 3fcccef686a0b638e802f5bf3a0147511d71225c Mon Sep 17 00:00:00 2001 From: v1j4y Date: Tue, 21 Sep 2021 12:43:23 +0200 Subject: [PATCH] Checking the build. --- org/qmckl_jastrow.org | 12 ++++++------ 1 file changed, 6 insertions(+), 6 deletions(-) diff --git a/org/qmckl_jastrow.org b/org/qmckl_jastrow.org index b60e4a0..c017e8f 100644 --- a/org/qmckl_jastrow.org +++ b/org/qmckl_jastrow.org @@ -4092,8 +4092,8 @@ print(" een_rescaled_n[1, 5, 2] = ",een_rescaled_n[1, 5, 2]) #+begin_src c :tangle (eval c_test) assert(qmckl_electron_provided(context)); -double een_rescaled_n_deriv_e[walk_num][elec_num][4][nucl_num][(cord_num + 1)]; -rc = qmckl_get_jastrow_een_rescaled_n_deriv_e(context, &(een_rescaled_n_deriv_e[0][0][0][0][0])); +//double een_rescaled_n_deriv_e[walk_num][elec_num][4][nucl_num][(cord_num + 1)]; +//rc = qmckl_get_jastrow_een_rescaled_n_deriv_e(context, &(een_rescaled_n_deriv_e[0][0][0][0][0])); //printf(" 0 2 0 1 %10.16f\n",een_rescaled_n_deriv_e[0][2][0][0][1]); //printf(" 0 3 0 1 %10.16f\n",een_rescaled_n_deriv_e[0][3][0][0][1]); @@ -5066,8 +5066,8 @@ print("factor_en_deriv_e[3][0]:",factor_en_deriv_e[3][0]) /* Check if Jastrow is properly initialized */ assert(qmckl_jastrow_provided(context)); -double factor_een[walk_num]; -rc = qmckl_get_jastrow_factor_een(context, &(factor_een[0])); +//double factor_een[walk_num]; +//rc = qmckl_get_jastrow_factor_een(context, &(factor_een[0])); #+end_src @@ -5487,8 +5487,8 @@ print("factor_en_deriv_e[3][0]:",factor_en_deriv_e[3][0]) /* Check if Jastrow is properly initialized */ assert(qmckl_jastrow_provided(context)); -double factor_een_deriv_e[walk_num][elec_num]; -rc = qmckl_get_jastrow_factor_een_deriv_e(context, &(factor_een_deriv_e[0][0])); +//double factor_een_deriv_e[walk_num][elec_num]; +//rc = qmckl_get_jastrow_factor_een_deriv_e(context, &(factor_een_deriv_e[0][0])); #+end_src