# Maple code to compute lists of point positions in hypercube-shaped molecules # $Header$ ################################################################################ # # 1D interpolation points # posn_list_1d_size2 := hypercube_points([ 0], [+1]); posn_list_1d_size3 := hypercube_points([-1], [+1]); posn_list_1d_size4 := hypercube_points([-1], [+2]); posn_list_1d_size5 := hypercube_points([-2], [+2]); posn_list_1d_size6 := hypercube_points([-2], [+3]); posn_list_1d_size7 := hypercube_points([-3], [+3]); ################################################################################ # # 2D interpolation points (Fortran ordering) # posn_list_2d_size2 := map(ListTools[Reverse], hypercube_points([ 0, 0], [+1,+1])); posn_list_2d_size3 := map(ListTools[Reverse], hypercube_points([-1,-1], [+1,+1])); posn_list_2d_size4 := map(ListTools[Reverse], hypercube_points([-1,-1], [+2,+2])); posn_list_2d_size5 := map(ListTools[Reverse], hypercube_points([-2,-2], [+2,+2])); posn_list_2d_size6 := map(ListTools[Reverse], hypercube_points([-2,-2], [+3,+3])); ################################################################################ # # 3D interpolation points (Fortran ordering) # posn_list_3d_size2 := map(ListTools[Reverse], hypercube_points([ 0, 0, 0], [+1,+1,+1])); posn_list_3d_size3 := map(ListTools[Reverse], hypercube_points([-1,-1,-1], [+1,+1,+1])); posn_list_3d_size4 := map(ListTools[Reverse], hypercube_points([-1,-1,-1], [+2,+2,+2])); posn_list_3d_size5 := map(ListTools[Reverse], hypercube_points([-2,-2,-2], [+2,+2,+2])); posn_list_3d_size6 := map(ListTools[Reverse], hypercube_points([-2,-2,-2], [+3,+3,+3]));