{ "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" [ [ 2.673592 1.767732 1.794498 ] [ 2.791934 4.53061 0.3856556 ] [ 2.184868 4.104179 2.619474 ] [ 3.820974 5.464835 2.237655 ] [ 4.399704 3.304978 2.526424 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.673592000000001e-10 1.767732e-10 1.794498e-10 ] [ 2.791934e-10 4.53061e-10 3.856556e-11 ] [ 2.184868e-10 4.104179e-10 2.619474e-10 ] [ 3.820974e-10 5.464835e-10 2.237655e-10 ] [ 4.399704e-10 3.304978e-10 2.526424e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2608075 -0.3803624 0.0120423 ] [ -0.4451954 -0.9115404 -5.5628437 ] [ -9.6959136 -2.7619805 4.2374215 ] [ 5.172453 8.5728657 1.3645226 ] [ 5.2294635 -4.5189824 -0.0511426 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.17859682471955e-10 -6.094077497321615e-10 1.92938916796182e-11 ] [ -7.132816674442836e-10 -1.460448729827013e-09 -8.912658194734104e-09 ] [ -1.553456621520282e-08 -4.425180620663636e-09 6.78909771570923e-09 ] [ 8.287183337063201e-09 1.373524511096005e-08 2.186206226284928e-09 ] [ 8.378524228055858e-09 -7.240208010737239e-09 -8.19394787220084e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -11.147033 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.785951581102692e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8848815 1.5195757 2.2618998 ] [ 2.3522152 5.437771 0.3902311 ] [ 1.9771061 3.7509648 2.0786061 ] [ 4.1832217 5.3005459 1.9059542 ] [ 4.4736475 3.1634767 2.9270155 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8848815e-10 1.5195757e-10 2.2618998e-10 ] [ 2.3522152e-10 5.437771e-10 3.902311e-11 ] [ 1.9771061e-10 3.7509648e-10 2.0786061e-10 ] [ 4.1832217e-10 5.3005459e-10 1.9059542e-10 ] [ 4.473647500000001e-10 3.1634767e-10 2.9270155e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.8e-06 9.11e-05 4.41e-05 ] [ 1.5e-06 8.9e-06 -1.53e-05 ] [ 5.98e-05 9.8e-06 -3.64e-05 ] [ -9.68e-05 -4.63e-05 3.96e-05 ] [ 3.18e-05 -6.34e-05 -3.2e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.088271209199999e-15 1.459582913574e-13 7.06559895594e-14 ] [ 2.403264951e-15 1.42593720426e-14 -2.45133025002e-14 ] [ 9.581016271319999e-14 1.57013310132e-14 -5.831922947759999e-14 ] [ -1.550906981712e-13 -7.41807781542e-14 6.34461947064e-14 ] [ 5.09492169612e-14 -1.015779985956e-13 -5.126965228799999e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.036401 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.409097034165423e-18 } }