{ "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" [ [ -0.1199396 1.1460436 -2.8631603 ] [ -7.0281031 8.1179964 2.7688661 ] [ -4.1968593 -7.3594027 0.8931346 ] [ 0.3201448 -2.1047739 -1.1034818 ] [ 1.6954924 0.3993365 -1.6255344 ] [ 7.2133106 -2.9612543 2.7878277 ] [ 2.1159542 2.7620545 -0.8576519 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.921644230281037e-10 1.836164262337467e-09 -4.587288494262715e-09 ] [ -1.1260262475392e-08 1.300646403981857e-08 4.436212531545675e-09 ] [ -6.724109851247054e-09 -1.17910629489924e-08 1.43095937534756e-09 ] [ 5.129285138306919e-10 -3.372219534650037e-09 -1.767972741438301e-09 ] [ 2.716478284024082e-09 6.398076041320991e-10 -2.604393211986155e-09 ] [ 1.155699760188882e-08 -4.74445240770347e-09 4.466592363758636e-09 ] [ 3.390132349923567e-09 4.425299145275434e-09 -1.374109822964699e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.657199 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.188124494341314e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.3567002 2.299094 1.7291389 ] [ 1.5253827 2.8977241 4.9283988 ] [ 1.3332111 0.4352369 4.2548606 ] [ 3.4743248 0.2422883 3.0213323 ] [ 5.4450124 2.4516479 0.5758567 ] [ 5.0014002 1.3558842 4.7079778 ] [ 3.7189746 3.3769343 3.8787869 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.3567002e-10 2.299094e-10 1.7291389e-10 ] [ 1.5253827e-10 2.8977241e-10 4.9283988e-10 ] [ 1.3332111e-10 4.352369e-11 4.2548606e-10 ] [ 3.4743248e-10 2.422883e-11 3.0213323e-10 ] [ 5.445012400000001e-10 2.4516479e-10 5.758567e-11 ] [ 5.0014002e-10 1.3558842e-10 4.7079778e-10 ] [ 3.7189746e-10 3.3769343e-10 3.8787869e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.63e-05 -5.28e-05 -7.93e-05 ] [ 4.4e-06 7.2e-06 3.47e-05 ] [ 1.85e-05 1.7e-05 -1.99e-05 ] [ 2.3e-05 3.61e-05 -3.95e-05 ] [ -5.95e-05 -2.59e-05 -2.62e-05 ] [ -2.45e-05 -3.8e-06 4.77e-05 ] [ -2.83e-05 2.22e-05 8.25e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.0622430995904e-13 -8.459492557824e-14 -1.2705260602944e-13 ] [ 7.04957713152e-15 1.153567166976e-14 5.559552874176001e-14 ] [ 2.96402674848e-14 2.72370025536e-14 -3.188331475392e-14 ] [ 3.68500622784e-14 5.783857601088001e-14 -6.32859765216e-14 ] [ -9.532950893760001e-14 -4.149637447872e-14 -4.197702746496e-14 ] [ -3.92533272096e-14 -6.08827115904e-15 7.642382481215999e-14 ] [ -4.534159836864e-14 3.556832098176e-14 1.32179571216e-13 ] ] } "relaxed-potential-energy" { "source-value" -20.454083 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.277105358250273e-18 } }