{ "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" [ [ 0.8442817 0.9206702 0.8357587 ] [ 0.3795063 0.7207018 2.571138 ] [ 0.5352031 2.484454 2.60301 ] [ 2.861465 0.7370648 0.0976718 ] [ 2.459453 1.267265 1.961226 ] [ 1.563309 2.840378 0.3371872 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.442817e-11 9.206702e-11 8.357587e-11 ] [ 3.795063e-11 7.207018e-11 2.571138e-10 ] [ 5.352031e-11 2.484454e-10 2.60301e-10 ] [ 2.861465e-10 7.370648e-11 9.767180000000001e-12 ] [ 2.459453e-10 1.267265e-10 1.961226e-10 ] [ 1.563309e-10 2.840378e-10 3.371872000000001e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -20.229519 -18.02322 -39.3841583 ] [ -14.5635546 -31.1611085 27.8875279 ] [ -4.7251171 35.3795289 10.1412262 ] [ 10.0055716 -5.1058536 -14.4892395 ] [ 27.0497668 1.0530481 24.7031407 ] [ 2.4628524 17.8576051 -8.8584971 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.24112623918294e-08 -2.887638171553497e-08 -6.310037765814627e-08 ] [ -2.333338669586429e-08 -4.992559951691216e-08 4.468074521328772e-08 ] [ -7.570472148162296e-09 5.668425405849794e-08 1.624803552388443e-08 ] [ 1.603069289526045e-08 -8.180479267147515e-09 -2.321432078007188e-08 ] [ 4.333850396505203e-08 1.687169046397861e-09 3.957879448987294e-08 ] [ 3.94592453576117e-09 2.861103739469885e-08 -1.41928769490446e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 38.689059 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.198670581055183e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.1474155 0.4058966 0.884075 ] [ -0.2425761 0.017625 2.6941565 ] [ 0.3512442 3.4815722 2.2866971 ] [ 3.5258887 0.6019828 0.0129228 ] [ 3.4180362 1.0460264 1.8350029 ] [ 1.4432096 3.4174308 0.6931373 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.474155e-11 4.058966e-11 8.840750000000001e-11 ] [ -2.425761e-11 1.7625e-12 2.6941565e-10 ] [ 3.512442e-11 3.4815722e-10 2.2866971e-10 ] [ 3.5258887e-10 6.019828000000001e-11 1.29228e-12 ] [ 3.4180362e-10 1.0460264e-10 1.8350029e-10 ] [ 1.4432096e-10 3.4174308e-10 6.931373e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.2188187 0.9165296 1.1766892 ] [ -0.2846602 -2.0530696 -0.1736927 ] [ -0.3278566 1.2597258 -1.2464389 ] [ 1.1576169 -1.5259811 -0.1448376 ] [ -0.7251117 1.1881384 -1.304792 ] [ 0.3988304 0.2146569 1.693072 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.505862053338489e-10 1.468442297391176e-09 1.885263926187856e-09 ] [ -4.560759173122521e-10 -3.289380113995208e-09 -2.782863831436282e-10 ] [ -5.252841794949773e-10 2.018303225378577e-09 -1.997015264835669e-09 ] [ 1.854706733022971e-09 -2.444891242202667e-09 -2.320554165327821e-10 ] [ -1.161757013208543e-09 1.903607566754719e-09 -2.090507237406874e-09 ] [ 6.389967425443123e-10 3.439182666734035e-10 2.712600375731097e-09 ] ] } "relaxed-potential-energy" { "source-value" -27.377133 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.386300243713217e-18 } }