{ "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" [ [ 2.55675 2.192965 3.527099 ] [ 1.806278 5.26626 2.450306 ] [ 0.8031725 3.384297 2.630387 ] [ 2.570894 3.149532 1.167105 ] [ 2.627788 4.286276 4.286712 ] [ 4.842075 2.861339 2.293967 ] [ 3.90768 5.002934 2.246314 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.55675e-10 2.192965e-10 3.527099e-10 ] [ 1.806278e-10 5.26626e-10 2.450306e-10 ] [ 8.031725e-11 3.384297e-10 2.630387e-10 ] [ 2.570894e-10 3.149532e-10 1.167105e-10 ] [ 2.627788e-10 4.286276e-10 4.286712e-10 ] [ 4.842075000000001e-10 2.861339e-10 2.293967e-10 ] [ 3.90768e-10 5.002934e-10 2.246314e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.7964666 -2.9272311 0.8632963 ] [ -2.4606782 5.876182 -0.8441646 ] [ -3.918917 -3.2755488 -0.6315757 ] [ 0.594967 -0.4158865 -1.1933908 ] [ 1.066128 0.9770056 2.7991804 ] [ 0.0345435 0.4664387 -0.0355264 ] [ 3.8874902 -0.70096 -0.9578193 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.276080176281424e-09 -4.689941270738117e-09 1.383153160078654e-09 ] [ -3.942441115833178e-09 9.414681497531387e-09 -1.352500797369956e-09 ] [ -6.278797247985377e-09 -5.248007750886739e-09 -1.011895829142194e-09 ] [ 9.53242225401078e-10 -6.663236326960409e-10 -1.912022854990567e-09 ] [ 1.708125370453152e-09 1.56533554360715e-09 4.484781431230773e-09 ] [ 5.534478855657899e-11 7.473171863333358e-10 -5.69195679701376e-11 ] [ 6.228445963343985e-09 -1.12306173336864e-09 -1.534595702054236e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.313975 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.972916301666015e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7776299 2.3942557 4.3981273 ] [ 2.5896687 4.8725464 3.0180791 ] [ 1.1628206 3.1624622 2.1785328 ] [ 1.5210289 1.8652348 0.3193066 ] [ 2.2045247 4.104305 5.2376729 ] [ 6.2649014 4.1962476 1.3227785 ] [ 4.5940634 5.5485514 2.1273928 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.776299e-11 2.3942557e-10 4.3981273e-10 ] [ 2.5896687e-10 4.8725464e-10 3.0180791e-10 ] [ 1.1628206e-10 3.1624622e-10 2.1785328e-10 ] [ 1.5210289e-10 1.8652348e-10 3.193066e-11 ] [ 2.2045247e-10 4.104305e-10 5.2376729e-10 ] [ 6.264901400000001e-10 4.196247600000001e-10 1.3227785e-10 ] [ 4.594063399999999e-10 5.5485514e-10 2.1273928e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.38e-05 -1.96e-05 2.88e-05 ] [ -3.92e-05 2.4e-05 -5.87e-05 ] [ -6.9e-06 4.38e-05 7.2e-06 ] [ 7.6e-06 -2.16e-05 -2.06e-05 ] [ 2.77e-05 -1.2e-06 -1.93e-05 ] [ -3.39e-05 -0.0 1.54e-05 ] [ 2.09e-05 -2.53e-05 4.72e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.81318038892e-14 -3.140266202639999e-14 4.614268705919999e-14 ] [ -6.280532405279998e-14 3.8452239216e-14 -9.404776841579999e-14 ] [ -1.10550187746e-14 7.01753365692e-14 1.15356717648e-14 ] [ 1.21765424184e-14 -3.46070152944e-14 -3.300483866039999e-14 ] [ 4.438029276179999e-14 -1.9226119608e-15 -3.09220090362e-14 ] [ -5.431378789259999e-14 0.0 2.46735201636e-14 ] [ 3.34854916506e-14 -4.053506884019999e-14 7.562273712480001e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.635287 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.665266813128396e-18 } }