{ "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" [ [ 2.272226 1.517825 2.823083 ] [ 2.079314 3.025232 4.309487 ] [ 1.624731 3.89644 2.167347 ] [ 4.204366 1.580563 1.938725 ] [ 4.130904 2.338344 4.256427 ] [ 3.588528 3.628489 1.149971 ] [ 3.881136 4.134812 3.114475 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.272226e-10 1.517825e-10 2.823083e-10 ] [ 2.079314e-10 3.025232e-10 4.309487e-10 ] [ 1.624731e-10 3.89644e-10 2.167347e-10 ] [ 4.204366000000001e-10 1.580563e-10 1.938725e-10 ] [ 4.130904e-10 2.338344e-10 4.256427000000001e-10 ] [ 3.588528e-10 3.628489e-10 1.149971e-10 ] [ 3.881136e-10 4.134812e-10 3.114475e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.2894622 -3.3753975 -2.1503 ] [ -9.646715 0.4099769 4.5060924 ] [ -3.7606111 -0.5911828 0.0343157 ] [ 2.3513056 -1.6137845 -4.167026 ] [ 5.0977732 -1.4240005 5.9883017 ] [ -0.5203758 -0.5458425 -5.6720839 ] [ 9.7680852 7.1402309 1.4607001 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.270299431845334e-09 -5.407982960406768e-09 -3.44516038770624e-09 ] [ -1.545574124052067e-08 6.568554042480595e-10 7.219555894444563e-09 ] [ -6.025163184340971e-09 -9.471792607790824e-10 5.497981226638656e-11 ] [ 3.767206860676116e-09 -2.585567796909418e-09 -6.676311635465741e-09 ] [ 8.167533039180802e-09 -2.281500309107511e-09 9.594316982036894e-09 ] [ -8.337339407900967e-10 -8.74536092139024e-10 -9.087680215796085e-09 ] [ 1.565019773742249e-08 1.143991101509374e-08 2.340299550220222e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.554121 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.690956591929432e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9258839 0.6899008 2.7354067 ] [ 0.6606123 2.4040562 3.2822133 ] [ 1.5043455 4.168472 2.2409739 ] [ 3.4741624 1.4830238 1.3604785 ] [ 5.4962199 3.5155437 5.2555379 ] [ 3.5966338 3.6728533 1.6924323 ] [ 5.1233471 4.1878552 3.1924724 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9258839e-10 6.899008000000001e-11 2.7354067e-10 ] [ 6.606123e-11 2.4040562e-10 3.2822133e-10 ] [ 1.5043455e-10 4.168472000000001e-10 2.2409739e-10 ] [ 3.4741624e-10 1.4830238e-10 1.3604785e-10 ] [ 5.4962199e-10 3.5155437e-10 5.2555379e-10 ] [ 3.5966338e-10 3.6728533e-10 1.6924323e-10 ] [ 5.1233471e-10 4.187855200000001e-10 3.1924724e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.0164037 -0.6203414 -0.8634024 ] [ -0.5122706 1.2626203 -0.119717 ] [ -0.1948768 -0.4992733 0.3314622 ] [ -0.564023 -0.4326578 0.5010344 ] [ 0.1727793 0.1687021 -0.0649851 ] [ -0.4486817 -0.0462703 -0.3227859 ] [ 0.5306691 0.1672204 0.5383937 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.628458245434617e-09 -9.938964879943413e-10 -1.38332313962261e-09 ] [ -8.207479788431885e-10 2.022940725607482e-09 -1.918077785123136e-10 ] [ -3.122270528963174e-10 -7.999240086496646e-10 5.310609875189338e-10 ] [ -9.036644641934785e-10 -6.931942119667622e-10 8.027456018965556e-10 ] [ 2.768229550181895e-10 2.702905604998637e-10 -1.041176079203501e-10 ] [ -7.188673299207993e-10 -7.413319289740224e-11 -5.171600225038868e-10 ] [ 8.502256254009773e-10 2.679166154008243e-10 8.626017989260089e-10 ] ] } "relaxed-potential-energy" { "source-value" -15.769199 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.526504196654274e-18 } }