{ "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" [ [ 1.931726 1.779285 1.793394 ] [ 2.022352 0.7174538 3.630998 ] [ 4.124201 0.9725878 2.711634 ] [ 3.467636 2.844975 3.645464 ] [ 5.471294 3.704408 2.165903 ] [ 3.262896 3.451778 1.529715 ] [ 3.831227 5.45457 3.339943 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.931726e-10 1.779285e-10 1.793394e-10 ] [ 2.022352e-10 7.174538e-11 3.630998e-10 ] [ 4.124201e-10 9.725878e-11 2.711634e-10 ] [ 3.467636e-10 2.844975e-10 3.645464e-10 ] [ 5.471294000000001e-10 3.704408e-10 2.165903e-10 ] [ 3.262896e-10 3.451778e-10 1.529715e-10 ] [ 3.831227000000001e-10 5.454570000000001e-10 3.339943e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.5055782 -1.0295519 -1.9974974 ] [ -0.9019054 -1.8021875 3.9833682 ] [ 2.6847738 1.0613883 -3.7168727 ] [ -0.6483251 2.098422 4.2691141 ] [ -1.68736 -1.7345163 2.4263466 ] [ 1.5258933 4.4993362 -2.5913939 ] [ 0.5325015 -3.0928909 -2.3730649 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.412202192826147e-09 -1.64952398408022e-09 -3.200343634388786e-09 ] [ -1.445011746053272e-09 -2.887422678798e-09 6.382059402078179e-09 ] [ 4.301481814496375e-09 1.700531519850657e-09 -5.955086542429772e-09 ] [ -1.038731317897822e-09 3.362042668972377e-09 6.839874802547634e-09 ] [ -2.703448742873088e-09 -2.779001464256519e-09 3.887435796477569e-09 ] [ 2.444750571095361e-09 7.208731268759114e-09 -4.151870721863733e-09 ] [ 8.531614538409311e-10 -4.955357490665071e-09 -3.80206910242109e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -23.483186 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.762421159109787e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7081052 1.9822013 2.0446835 ] [ 2.5483727 0.5116494 3.7512974 ] [ 4.0970547 1.3562897 2.1518405 ] [ 3.08233 3.0097745 3.7865353 ] [ 5.3320657 3.2971543 2.8730444 ] [ 3.418412 3.521174 1.3245091 ] [ 3.9249917 5.2468145 2.8851408 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7081052e-10 1.9822013e-10 2.0446835e-10 ] [ 2.5483727e-10 5.116494e-11 3.7512974e-10 ] [ 4.0970547e-10 1.3562897e-10 2.1518405e-10 ] [ 3.08233e-10 3.0097745e-10 3.7865353e-10 ] [ 5.332065700000001e-10 3.2971543e-10 2.8730444e-10 ] [ 3.418412e-10 3.521174e-10 1.3245091e-10 ] [ 3.9249917e-10 5.2468145e-10 2.8851408e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.45e-05 -5.5e-05 1.15e-05 ] [ 7.23e-05 5.1e-05 -3.16e-05 ] [ -6.58e-05 3.72e-05 -4.3e-06 ] [ -8.39e-05 1.02e-05 -1.29e-05 ] [ 7.67e-05 -1.82e-05 2.29e-05 ] [ 2e-07 -1.34e-05 1.13e-05 ] [ 2.49e-05 -1.18e-05 3.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.92533272096e-14 -8.8119714144e-14 1.84250311392e-14 ] [ 1.1583736968384e-13 8.17110076608e-14 -5.062878121728e-14 ] [ -1.0542322164864e-13 5.960097029376001e-14 -6.889359469440001e-15 ] [ -1.3442261848512e-13 1.634220153216e-14 -2.066807840832e-14 ] [ 1.2288694681536e-13 -2.915961449856e-14 3.668984461632e-14 ] [ 3.2043532416e-16 -2.146916671872e-14 1.810459581504e-14 ] [ 3.989419785791999e-14 -1.890568412544e-14 4.96674752448e-15 ] ] } "relaxed-potential-energy" { "source-value" -28.889965 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.628682649873028e-18 } }