{ "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" [ [ 2.851893 1.689536 1.360291 ] [ 1.367517 2.93292 5.4803 ] [ 1.756353 1.339195 3.328571 ] [ 1.204701 3.536746 3.011508 ] [ 3.888723 1.68848 3.240915 ] [ 3.83892 3.544284 1.733331 ] [ 3.269318 3.65155 3.991072 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.851893e-10 1.689536e-10 1.360291e-10 ] [ 1.367517e-10 2.93292e-10 5.4803e-10 ] [ 1.756353e-10 1.339195e-10 3.328571e-10 ] [ 1.204701e-10 3.536746e-10 3.011508e-10 ] [ 3.888723e-10 1.68848e-10 3.240915e-10 ] [ 3.83892e-10 3.544284e-10 1.733331e-10 ] [ 3.269318e-10 3.65155e-10 3.991072e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.0351276 -4.6668417 -9.1545797 ] [ 0.7553812 -0.0573557 -2.4360399 ] [ -6.3962005 -2.8909288 3.3068395 ] [ -3.4912804 1.6966549 0.3279126 ] [ 9.4969942 -4.7909583 5.3626096 ] [ 3.3757987 6.3190435 -2.5346061 ] [ 0.2944344 4.3903861 5.1278639 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.464987155928498e-09 -7.477104726316837e-09 -1.466725368943073e-08 ] [ 1.210254108402881e-09 -9.189396236671379e-11 -3.902966207271696e-09 ] [ -1.024784298747912e-08 -4.631778573917659e-09 5.298140979288243e-09 ] [ -5.593647879622173e-09 2.718340836741606e-09 5.253739057141883e-10 ] [ 1.521586220047352e-08 -7.675961442728362e-09 8.591847798384086e-09 ] [ 5.408625798227575e-09 1.012422384492958e-08 -4.060886669813867e-09 ] [ 4.717359159258095e-10 7.034174023658387e-09 8.215743722912112e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.506273 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.683290511102508e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.1248224 1.4727161 1.314189 ] [ 1.6797647 2.6467168 5.3374799 ] [ 1.45286 1.3776054 3.1784887 ] [ 0.8801583 3.8197126 3.2606798 ] [ 3.9139453 1.4419867 3.6891993 ] [ 3.8071435 3.7589602 1.497246 ] [ 3.3187308 3.8650132 3.8687053 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.1248224e-10 1.4727161e-10 1.314189e-10 ] [ 1.6797647e-10 2.6467168e-10 5.3374799e-10 ] [ 1.45286e-10 1.3776054e-10 3.1784887e-10 ] [ 8.801583e-11 3.8197126e-10 3.2606798e-10 ] [ 3.9139453e-10 1.4419867e-10 3.6891993e-10 ] [ 3.8071435e-10 3.7589602e-10 1.497246e-10 ] [ 3.3187308e-10 3.8650132e-10 3.8687053e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.59e-05 4.6e-06 -4.24e-05 ] [ 7e-06 1.03e-05 -3.68e-05 ] [ -2.41e-05 3.59e-05 5.34e-05 ] [ -1.92e-05 -3.53e-05 3.5e-05 ] [ -2.33e-05 3.5e-05 2.8e-06 ] [ 2.76e-05 -4.7e-06 1e-06 ] [ -3.9e-06 -4.57e-05 -1.3e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.751814116059999e-14 7.370012516399999e-15 -6.79322892816e-14 ] [ 1.1215236438e-14 1.65024193302e-14 -5.896010013119999e-14 ] [ -3.86124568794e-14 5.751814116059999e-14 8.555623225559998e-14 ] [ -3.076179137279999e-14 -5.655683518019999e-14 5.607618218999999e-14 ] [ -3.733071557219999e-14 5.607618218999999e-14 4.486094575199999e-15 ] [ 4.42200750984e-14 -7.530230179799999e-15 1.602176634e-15 ] [ -6.248488872599999e-15 -7.32194721738e-14 -2.082829624199999e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.28303 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.608829019672102e-18 } }