{ "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" [ [ 1.63984 2.632724 3.733643 ] [ 2.059322 3.100925 1.548727 ] [ 0.4497259 4.960249 3.35449 ] [ 2.730005 4.489518 3.533282 ] [ 4.056337 2.434117 2.913545 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.63984e-10 2.632724e-10 3.733643e-10 ] [ 2.059322e-10 3.100925e-10 1.548727e-10 ] [ 4.497259e-11 4.960249e-10 3.35449e-10 ] [ 2.730005e-10 4.489518e-10 3.533282e-10 ] [ 4.056337e-10 2.434117e-10 2.913545e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6554786 -1.367769 1.2524754 ] [ 0.2162324 -0.1435046 -1.6821969 ] [ 0.1430066 -0.7329201 0.171222 ] [ 1.496503 2.2487469 0.2846306 ] [ -0.2002634 -0.0045533 -0.026131 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.652369131007032e-09 -2.191407532509546e-09 2.006686820539803e-09 ] [ 3.464424987937415e-10 -2.299197169915164e-10 -2.695176566967234e-09 ] [ 2.291218330277844e-10 -1.174267458808943e-09 2.74327887626748e-10 ] [ 2.397662139310902e-09 3.602889738959934e-09 4.560284966414004e-10 ] [ -3.208573401253956e-10 -7.295190867592199e-12 -4.1866477623054e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -9.732065432689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.559248783681449e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4485809 2.336696 4.1235397 ] [ 1.9905743 3.3411615 1.2540651 ] [ 0.8701742 4.3956445 3.073294 ] [ 3.1219822 4.8926667 3.6726081 ] [ 3.5039182 2.6513643 2.96018 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4485809e-10 2.336696e-10 4.1235397e-10 ] [ 1.9905743e-10 3.3411615e-10 1.2540651e-10 ] [ 8.701742000000001e-11 4.395644500000001e-10 3.073294e-10 ] [ 3.121982200000001e-10 4.892666700000001e-10 3.6726081e-10 ] [ 3.5039182e-10 2.6513643e-10 2.96018e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.19e-05 -2.85e-05 3.31e-05 ] [ 2.9e-05 -1.7e-05 -3.31e-05 ] [ -3.25e-05 3.63e-05 2.11e-05 ] [ 1.12e-05 -1.8e-05 -7.3e-06 ] [ 1.41e-05 2.71e-05 -1.37e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.50876682846e-14 -4.5662034069e-14 5.303204658539999e-14 ] [ 4.6463122386e-14 -2.723700277799999e-14 -5.303204658539999e-14 ] [ -5.207074060499999e-14 5.81590118142e-14 3.38059269774e-14 ] [ 1.79443783008e-14 -2.8839179412e-14 -1.16958894282e-14 ] [ 2.25906905394e-14 4.34189867814e-14 -2.19498198858e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.674324432689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.03065064577907e-18 } }