{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.982478 1.406412 2.920232 ] [ 1.664708 2.759694 5.087468 ] [ 1.282886 3.129979 1.519732 ] [ 2.3658 4.253432 3.372825 ] [ 3.481612 3.001234 2.026348 ] [ 4.008994 2.747584 4.108071 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.982478e-10 1.406412e-10 2.920232e-10 ] [ 1.664708e-10 2.759694e-10 5.087468e-10 ] [ 1.282886e-10 3.129979e-10 1.519732e-10 ] [ 2.3658e-10 4.253432e-10 3.372825e-10 ] [ 3.481612e-10 3.001234e-10 2.026348e-10 ] [ 4.008994e-10 2.747584e-10 4.108071e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7257926 -3.161305 1.1619726 ] [ -0.3800888 0.2455741 0.3665513 ] [ -4.9055013 1.3267956 -2.8925472 ] [ -4.2479197 5.5398595 4.3467965 ] [ 6.918176 -2.5415308 -8.3047922 ] [ 3.3411264 -1.4093935 5.3220192 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.162847944850108e-09 -5.06496900394737e-09 1.861685349068228e-09 ] [ -6.089693942050992e-10 3.934530849355793e-10 5.872799280223242e-10 ] [ -7.859479560916623e-09 2.12576090841401e-09 -4.634371536582125e-09 ] [ -6.805917686448289e-09 8.875833446542923e-09 6.96433578505298e-09 ] [ 1.108413993709958e-08 -4.071981262351327e-09 -1.330574401306545e-08 ] [ 5.353074649320537e-09 -2.258097333811479e-09 8.526814807939372e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.145469 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.305048010477135e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4347255 0.4485079 1.8712519 ] [ 0.9290465 4.1135311 5.9775002 ] [ 2.059747 1.9763425 1.3301012 ] [ 2.3661817 4.6469456 4.2693053 ] [ 3.3556791 3.1840731 2.7964795 ] [ 5.6410983 2.9289348 2.7900378 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.347255e-11 4.485079e-11 1.8712519e-10 ] [ 9.290465e-11 4.1135311e-10 5.9775002e-10 ] [ 2.059747e-10 1.9763425e-10 1.3301012e-10 ] [ 2.3661817e-10 4.6469456e-10 4.2693053e-10 ] [ 3.3556791e-10 3.1840731e-10 2.7964795e-10 ] [ 5.641098300000001e-10 2.9289348e-10 2.7900378e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4e-07 4e-07 -1e-07 ] [ 2.1e-06 1.2e-06 -2.5e-06 ] [ 4.8e-06 -1.3e-06 -6e-07 ] [ -7.1e-06 9e-07 4.5e-06 ] [ -1e-07 4e-06 4.6e-06 ] [ -2e-07 -5.3e-06 -6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.408706536e-16 6.408706536e-16 -1.602176634e-16 ] [ 3.364570931399999e-15 1.9226119608e-15 -4.005441585e-15 ] [ 7.690447843199998e-15 -2.0828296242e-15 -9.613059803999998e-16 ] [ -1.13754541014e-14 1.4419589706e-15 7.209794853e-15 ] [ -1.602176634e-16 6.408706535999999e-15 7.370012516399999e-15 ] [ -3.204353268e-16 -8.4915361602e-15 -9.613059803999999e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.241848 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.121577945657963e-18 } }