{ "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" [ [ 1.715482 1.558119 0.3191032 ] [ 2.111919 2.384646 2.793656 ] [ 0.6473775 3.949576 0.9928713 ] [ 3.842985 1.188798 1.171985 ] [ 3.145034 3.056438 0.3971002 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.715482e-10 1.558119e-10 3.191032e-11 ] [ 2.111919e-10 2.384646e-10 2.793656e-10 ] [ 6.473775000000001e-11 3.949576e-10 9.928713000000001e-11 ] [ 3.842985e-10 1.188798e-10 1.171985e-10 ] [ 3.145034e-10 3.056438e-10 3.971002e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.467876 -3.0884257 -0.0524653 ] [ -1.8200405 2.3925051 -4.5769472 ] [ 5.8176184 -5.591881 2.1272307 ] [ 2.4259228 -4.0587308 2.9744205 ] [ 1.0443754 10.3465324 -0.4722387 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.196485643280938e-08 -4.948203492385094e-09 -8.405867775580018e-11 ] [ -2.916026362033677e-09 3.833215767945834e-09 -7.333077858891724e-09 ] [ 9.320852266008464e-09 -8.959181078308552e-09 3.408199322667464e-09 ] [ 3.886756826047855e-09 -6.502803651456127e-09 4.765547024790597e-09 ] [ 1.673273863004404e-09 1.657697245420394e-08 -7.566098108105357e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -10.343159 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.65715676715468e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4986296 1.4502237 0.3303539 ] [ 2.1741106 2.4398018 2.6244388 ] [ 0.8208309 3.7282973 1.0071765 ] [ 3.7642837 1.1267283 1.2627086 ] [ 3.2049427 3.3925259 0.450038 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4986296e-10 1.4502237e-10 3.303539e-11 ] [ 2.1741106e-10 2.4398018e-10 2.6244388e-10 ] [ 8.208309e-11 3.7282973e-10 1.0071765e-10 ] [ 3.7642837e-10 1.1267283e-10 1.2627086e-10 ] [ 3.2049427e-10 3.3925259e-10 4.50038e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4e-06 -8e-07 0.0 ] [ -1.48e-05 -1.07e-05 2.8e-05 ] [ -4e-06 1.77e-05 -4.2e-06 ] [ 1.62e-05 -3.1e-06 -5.4e-06 ] [ -1.3e-06 -3.1e-06 -1.83e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.408706535999999e-15 -1.2817413072e-15 0.0 ] [ -2.37122141832e-14 -1.71432899838e-14 4.486094575199999e-14 ] [ -6.408706535999999e-15 2.83585264218e-14 -6.729141862799999e-15 ] [ 2.59552614708e-14 -4.9667475654e-15 -8.6517538236e-15 ] [ -2.0828296242e-15 -4.9667475654e-15 -2.93198324022e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.399219 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.146791559564885e-18 } }