{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.5094065 0.6220131 0.2703167 ] [ 0.4530106 0.160144 2.650194 ] [ 0.6482707 2.949508 2.588273 ] [ 2.962565 0.672996 2.425796 ] [ 1.742585 2.553059 0.6145101 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.094065e-11 6.220131e-11 2.703167e-11 ] [ 4.530106e-11 1.60144e-11 2.650194e-10 ] [ 6.482707e-11 2.949508e-10 2.588273e-10 ] [ 2.962565e-10 6.72996e-11 2.425796e-10 ] [ 1.742585e-10 2.553059e-10 6.145100999999999e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1302037 -0.8655001 0.183017 ] [ -0.5918249 -1.0134581 2.0776218 ] [ -0.3453753 -1.5787081 1.3449609 ] [ -2.174464 1.243441 -1.1504023 ] [ 3.241868 2.2142254 -2.4551973 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.086093258003458e-10 -1.386684036944663e-09 2.93225561024778e-10 ] [ -9.482080261993866e-10 -1.623738887358035e-09 3.328717102249021e-09 ] [ -5.533522356207402e-10 -2.529369229726535e-09 2.15486492762361e-09 ] [ -3.483875412274176e-09 1.992212115957594e-09 -1.843147684759858e-09 ] [ 5.194045160112312e-09 3.547580198289304e-09 -3.933659745919888e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.387395 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.824461819112843e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5833382 0.7733084 0.5606946 ] [ 0.3952346 0.0860115 2.9256778 ] [ 0.6200869 2.4968421 2.4375756 ] [ 2.5860769 0.904482 2.1311838 ] [ 2.1311011 2.6970761 0.4939581 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.833382e-11 7.733084e-11 5.606946e-11 ] [ 3.952346e-11 8.601150000000001e-12 2.9256778e-10 ] [ 6.200869000000001e-11 2.4968421e-10 2.4375756e-10 ] [ 2.5860769e-10 9.04482e-11 2.1311838e-10 ] [ 2.1311011e-10 2.6970761e-10 4.939581e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5e-07 -1.8e-06 -1.9e-06 ] [ -2.5e-06 -7e-07 1.6e-06 ] [ -1e-07 1.6e-06 1.5e-06 ] [ 2.6e-06 -1.2e-06 -0.0 ] [ -5e-07 2.1e-06 -1.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.010883169999999e-16 -2.8839179412e-15 -3.0441356046e-15 ] [ -4.005441585e-15 -1.1215236438e-15 2.5634826144e-15 ] [ -1.602176634e-16 2.5634826144e-15 2.403264951e-15 ] [ 4.165659248399999e-15 -1.9226119608e-15 0.0 ] [ -8.010883169999999e-16 3.364570931399999e-15 -1.7623942974e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.29999 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.291110984443366e-18 } }