{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.1854996 0.4736791 1.206297 ] [ 0.6742688 0.1009159 2.297624 ] [ 0.6067687 1.83215 2.754335 ] [ 0.1838578 2.712055 1.507331 ] [ 1.981528 1.354685 0.3328332 ] [ 2.901733 2.736996 1.329123 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.854996e-11 4.736791e-11 1.206297e-10 ] [ 6.742688e-11 1.009159e-11 2.297624e-10 ] [ 6.067687000000001e-11 1.83215e-10 2.754335e-10 ] [ 1.838578e-11 2.712055e-10 1.507331e-10 ] [ 1.981528e-10 1.354685e-10 3.328332e-11 ] [ 2.901733e-10 2.736996e-10 1.329123e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -33.2647984 15.7108154 -65.6271656 ] [ 29.4230305 -31.6910261 60.4931398 ] [ 6.9304402 1.8834688 21.8682742 ] [ -4.4524494 13.1309696 -16.1497453 ] [ 0.3997757 -3.3788275 -4.4002464 ] [ 0.9640014 4.3445998 3.8157434 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.329608229210524e-08 2.51715011275846e-08 -1.0514631041369e-07 ] [ 4.714089158018534e-08 -5.07746211065826e-08 9.692069430634598e-08 ] [ 1.110378926029248e-08 3.017649677366231e-09 3.503683766048382e-08 ] [ -7.133610333974987e-09 2.103813250155553e-08 -2.587474435153468e-08 ] [ 6.405112801039546e-10 -5.413478426216112e-09 -7.049971907839366e-09 ] [ 1.544500505498469e-09 6.960816226292356e-09 6.113494866451903e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 3.875914 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.209898795031412e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.4223214 0.7735573 1.1468243 ] [ 1.2799396 -0.3519793 2.2880764 ] [ 0.7651262 1.8896866 3.0058328 ] [ 0.4276684 2.9534039 0.7998604 ] [ 1.9271287 1.0249694 0.4198062 ] [ 2.5561143 2.9208432 1.7671432 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.223214e-11 7.735573000000001e-11 1.1468243e-10 ] [ 1.2799396e-10 -3.519793e-11 2.2880764e-10 ] [ 7.651262e-11 1.8896866e-10 3.0058328e-10 ] [ 4.276684e-11 2.9534039e-10 7.998604e-11 ] [ 1.9271287e-10 1.0249694e-10 4.198062e-11 ] [ 2.5561143e-10 2.920843200000001e-10 1.7671432e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.9e-06 -1e-07 9.2e-06 ] [ -5.2e-06 -8e-07 -2.9e-06 ] [ -5.6e-06 8e-07 -7.5e-06 ] [ 1.6e-06 -2.1e-06 4.4e-06 ] [ 2.7e-06 2.3e-06 -9e-07 ] [ -4e-07 -1e-07 -2.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.105501868352e-14 -1.6021766208e-16 1.474002491136e-14 ] [ -8.33131842816e-15 -1.28174129664e-15 -4.646312200320001e-15 ] [ -8.972189076479999e-15 1.28174129664e-15 -1.2016324656e-14 ] [ 2.56348259328e-15 -3.36457090368e-15 7.04957713152e-15 ] [ 4.32587687616e-15 3.68500622784e-15 -1.44195895872e-15 ] [ -6.408706483200001e-16 -1.6021766208e-16 -3.68500622784e-15 ] ] } "relaxed-potential-energy" { "source-value" -26.320379 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.216989588439529e-18 } }