{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.975716 3.919 3.294603 ] [ 5.229011 2.380728 1.260294 ] [ 3.72512 0.5184044 0.8589665 ] [ 3.15133 1.64182 3.064405 ] [ 5.039876 3.004083 3.766304 ] [ 5.090657 4.730463 1.850516 ] [ 3.207695 3.468122 0.7711985 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.975716e-10 3.919e-10 3.294603e-10 ] [ 5.229011e-10 2.380728e-10 1.260294e-10 ] [ 3.72512e-10 5.184044e-11 8.589665e-11 ] [ 3.151330000000001e-10 1.64182e-10 3.064405e-10 ] [ 5.039876e-10 3.004083e-10 3.766304e-10 ] [ 5.090657000000001e-10 4.730463000000001e-10 1.850516e-10 ] [ 3.207695e-10 3.468122e-10 7.711985e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7204937 3.3175439 -1.9402026 ] [ 0.1664281 -2.394905 1.7653172 ] [ -0.5562214 2.4455732 1.6912684 ] [ 0.9325307 -0.1152626 -6.8772822 ] [ 2.927996 -0.1056907 -0.5761747 ] [ -0.8429969 0.8184654 2.1175831 ] [ -1.9072428 -3.9657242 3.8194908 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.154358171084206e-09 5.315291318849232e-09 -3.108547270946048e-09 ] [ 2.666472130610154e-10 -3.837060831649769e-09 2.828349969438304e-09 ] [ -8.911649304107674e-10 3.918240237776609e-09 2.709710712302565e-09 ] [ 1.494078898027664e-09 -1.846710444940884e-10 -1.101862084626411e-08 ] [ 4.691166775645463e-09 -1.693351699711038e-10 -9.231336414419597e-10 ] [ -1.350629935714435e-09 1.311326139617464e-09 3.392742163373285e-09 ] [ -3.055739849524735e-09 -6.353790650128342e-09 6.119498913537967e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -23.426216 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.753293589823694e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.9167545 4.1215019 3.251529 ] [ 5.3792391 2.2024299 1.5158688 ] [ 3.5362027 0.6903157 0.5631814 ] [ 3.342085 1.6637751 2.9307921 ] [ 5.1717784 3.1265648 3.8454906 ] [ 4.9516416 4.6595578 1.8381799 ] [ 3.1217036 3.1984752 0.9212451 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9167545e-10 4.1215019e-10 3.251529e-10 ] [ 5.379239100000001e-10 2.2024299e-10 1.5158688e-10 ] [ 3.5362027e-10 6.903157e-11 5.631814e-11 ] [ 3.342085e-10 1.6637751e-10 2.9307921e-10 ] [ 5.171778400000001e-10 3.1265648e-10 3.8454906e-10 ] [ 4.951641600000001e-10 4.6595578e-10 1.8381799e-10 ] [ 3.1217036e-10 3.1984752e-10 9.212451000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.2e-06 1.13e-05 -2.5e-06 ] [ -1.9e-06 -1.39e-05 -3.2e-06 ] [ 4e-06 8.9e-06 8.8e-06 ] [ 4.8e-06 -1.39e-05 -7.1e-06 ] [ 7e-07 1.3e-06 2.4e-06 ] [ -4.8e-06 4.8e-06 3.9e-06 ] [ -4e-06 1.4e-06 -2.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.9226119608e-15 1.81045959642e-14 -4.005441585e-15 ] [ -3.0441356046e-15 -2.22702552126e-14 -5.1269652288e-15 ] [ 6.408706535999999e-15 1.42593720426e-14 1.40991543792e-14 ] [ 7.690447843199998e-15 -2.22702552126e-14 -1.13754541014e-14 ] [ 1.1215236438e-15 2.0828296242e-15 3.845223921599999e-15 ] [ -7.690447843199998e-15 7.690447843199998e-15 6.248488872599999e-15 ] [ -6.408706535999999e-15 2.2430472876e-15 -3.685006258199999e-15 ] ] } "relaxed-potential-energy" { "source-value" -25.837867 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.139682677979968e-18 } }