cp2kdata.plots.test_plot module#

cp2kdata.plots.test_plot.basis_dir_name_converter(basis_test_sub_dir)[source]#
cp2kdata.plots.test_plot.basis_dir_name_order(basis_dir_name)[source]#
cp2kdata.plots.test_plot.basis_name_order(basis_name)[source]#
cp2kdata.plots.test_plot.get_U_list(U_test_sub_dir_list)[source]#
cp2kdata.plots.test_plot.get_basis_name_list(basis_test_sub_dir_list)[source]#
cp2kdata.plots.test_plot.get_cell_param(cp2k_out)[source]#
cp2kdata.plots.test_plot.get_cutoff_list(cutoff_test_sub_dir_list)[source]#
cp2kdata.plots.test_plot.get_dos_param(cp2k_pdos)[source]#
cp2kdata.plots.test_plot.get_e_f_s(cp2k_out_name)[source]#
cp2kdata.plots.test_plot.get_err_per_atom(array, num_atoms)[source]#
cp2kdata.plots.test_plot.get_exp_collect_from_yaml(yaml_file)[source]#
cp2kdata.plots.test_plot.get_matrix_rmse_and_max_err(matrix_list)[source]#
cp2kdata.plots.test_plot.get_min_gap(U_test_sub_dir)[source]#
cp2kdata.plots.test_plot.get_multiple_cell_param(U_test_sub_dir_list)[source]#
cp2kdata.plots.test_plot.get_multiple_e_f_s(cutoff_test_sub_dir_list)[source]#
cp2kdata.plots.test_plot.get_multiple_min_gap(U_test_sub_dir_list)[source]#
cp2kdata.plots.test_plot.get_num_atoms(cutoff_test_sub_dir_list)[source]#
cp2kdata.plots.test_plot.plot_U_test(target_dir='.', exp_collect=(None, None, None, None, None, None, None, None, None))[source]#
cp2kdata.plots.test_plot.plot_axes_U(U_list, y_list, ax, idx)[source]#
cp2kdata.plots.test_plot.plot_axes_basis(basis_list, y_list, ax, idx)[source]#
cp2kdata.plots.test_plot.plot_axes_cutoff(cutoff_list, y_list, ax, idx)[source]#
cp2kdata.plots.test_plot.plot_axes_exp(exp_value, ax, idx)[source]#
cp2kdata.plots.test_plot.plot_basis_test(target_dir='.')[source]#
cp2kdata.plots.test_plot.plot_cutoff_test(target_dir='.')[source]#