{ "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" [ [ 2.648062 2.256008 1.840542 ] [ 2.082623 2.792532 4.589039 ] [ 1.893054 0.6019814 4.219017 ] [ 3.79314 0.2675402 2.698761 ] [ 5.137376 2.400602 1.294264 ] [ 4.215429 1.396012 4.868853 ] [ 4.085322 3.344134 3.585876 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.648062e-10 2.256008e-10 1.840542e-10 ] [ 2.082623e-10 2.792532e-10 4.589039e-10 ] [ 1.893054e-10 6.019814000000001e-11 4.219017e-10 ] [ 3.79314e-10 2.675402e-11 2.698761000000001e-10 ] [ 5.137376e-10 2.400602e-10 1.294264e-10 ] [ 4.215429000000001e-10 1.396012e-10 4.868853e-10 ] [ 4.085322e-10 3.344134e-10 3.585876e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0748534 -0.6537338 7.776163 ] [ -1.6294792 1.4625526 -4.4918425 ] [ -1.974093 -0.7632348 -2.854777 ] [ 2.9471455 2.7324886 -3.4682603 ] [ -4.1296705 -2.7537381 4.5286037 ] [ 3.3328309 -1.3071789 2.0058957 ] [ 2.5281199 1.2828446 -3.4957825 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.722105002455455e-09 -1.047397019216029e-09 1.245878666077534e-08 ] [ -2.610713499829013e-09 2.343267601715948e-09 -7.196725097108144e-09 ] [ -3.162845677942962e-09 -1.222836962815663e-09 -4.573857004680617e-09 ] [ 4.721847657098246e-09 4.377929387591372e-09 -5.556765613289829e-09 ] [ -6.616461581219096e-09 -4.411974839975555e-09 7.255623032785944e-09 ] [ 5.33978379305319e-09 -2.094331490037822e-09 3.213799220781074e-09 ] [ 4.050494631730416e-09 2.055343643173076e-09 -5.600861039046104e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -22.042153 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.5315422499653e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4956803 2.2338366 2.1521817 ] [ 2.1646205 2.8755687 4.6121523 ] [ 1.9902085 0.5265285 3.9967645 ] [ 3.7749422 0.0279602 2.4177523 ] [ 5.0523716 2.0688756 2.0572449 ] [ 4.3200322 1.4972513 4.4467786 ] [ 4.0571507 3.8287887 3.4134777 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4956803e-10 2.2338366e-10 2.1521817e-10 ] [ 2.1646205e-10 2.8755687e-10 4.6121523e-10 ] [ 1.9902085e-10 5.265285e-11 3.9967645e-10 ] [ 3.7749422e-10 2.79602e-12 2.4177523e-10 ] [ 5.0523716e-10 2.0688756e-10 2.0572449e-10 ] [ 4.3200322e-10 1.4972513e-10 4.4467786e-10 ] [ 4.0571507e-10 3.8287887e-10 3.4134777e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.61e-05 -1.2e-06 -6.41e-05 ] [ -5.5e-05 7.58e-05 0.0001069 ] [ -7.79e-05 -0.0001053 3.42e-05 ] [ -6e-06 -6.8e-06 -5.03e-05 ] [ -1.8e-06 -1.71e-05 5.7e-05 ] [ 7.11e-05 1.27e-05 -4.11e-05 ] [ 3.5e-06 4.2e-05 -4.26e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.059038755074e-13 -1.9226119608e-15 -1.026995222394e-13 ] [ -8.811971486999999e-14 1.214449888572e-13 1.712726821746e-13 ] [ -1.248095597886e-13 -1.687091995602e-13 5.479444088279999e-14 ] [ -9.613059803999999e-15 -1.08948011112e-14 -8.05894846902e-14 ] [ -2.8839179412e-15 -2.73972204414e-14 9.132406813799999e-14 ] [ 1.139147586774e-13 2.03476432518e-14 -6.58494596574e-14 ] [ 5.607618218999999e-15 6.729141862799998e-14 -6.82527246084e-14 ] ] } "relaxed-potential-energy" { "source-value" -26.557231 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.254937497194045e-18 } }