{ "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" [ [ 0.1724043 0.1217148 2.355607 ] [ 0.0803944 1.628444 0.6781111 ] [ 0.0194903 2.198586 2.964695 ] [ 2.614645 0.684385 2.185781 ] [ 2.191382 2.601245 1.67848 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.724043e-11 1.217148e-11 2.355607e-10 ] [ 8.03944e-12 1.628444e-10 6.781111e-11 ] [ 1.94903e-12 2.198586e-10 2.964695e-10 ] [ 2.614645e-10 6.84385e-11 2.185781e-10 ] [ 2.191382e-10 2.601245e-10 1.67848e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1274138 -6.4426744 1.3829984 ] [ -1.1964125 1.4403149 -5.5135349 ] [ -1.5220662 4.6842265 4.1859523 ] [ 2.299486 -4.9818151 1.3326936 ] [ 0.5464065 5.2999482 -1.3881094 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.04139411527287e-10 -1.032230229910667e-08 2.215807703083807e-09 ] [ -1.91686413633288e-09 2.30763885936989e-09 -8.833656714744865e-09 ] [ -2.438618880949897e-09 7.504958184831812e-09 6.706634910843988e-09 ] [ 3.684182709056909e-09 -7.981747682368416e-09 2.135210528609787e-09 ] [ 8.754397197531553e-10 8.491453097491042e-09 -2.223996427792716e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.7441312 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.561181919864785e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3254489 -0.0146967 2.3547124 ] [ 0.0214916 1.7264394 0.5459192 ] [ -0.0174406 2.3962465 3.0369606 ] [ 2.6655248 0.4467485 2.2673832 ] [ 2.0832913 2.6796372 1.6576987 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.254489e-11 -1.46967e-12 2.3547124e-10 ] [ 2.14916e-12 1.7264394e-10 5.459192000000001e-11 ] [ -1.74406e-12 2.3962465e-10 3.0369606e-10 ] [ 2.6655248e-10 4.467485e-11 2.2673832e-10 ] [ 2.0832913e-10 2.679637200000001e-10 1.6576987e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.34e-05 -1.64e-05 1.28e-05 ] [ 1.71e-05 -3.5e-06 1.38e-05 ] [ 6.2e-06 1.94e-05 -2.51e-05 ] [ 1.73e-05 -2.73e-05 -1.93e-05 ] [ -2.73e-05 2.78e-05 1.79e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.146916671872e-14 -2.627569658112e-14 2.050786074624e-14 ] [ 2.739722021568e-14 -5.6076181728e-15 2.211003736704e-14 ] [ 9.93349504896e-15 3.108222644352e-14 -4.021463318208e-14 ] [ 2.771765553984e-14 -4.373942174784e-14 -3.092200878144e-14 ] [ -4.373942174784e-14 4.454051005824e-14 2.867896151232001e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.878088 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.903079489340503e-18 } }