{ "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" [ [ 2.026325 2.332401 2.957561 ] [ 3.78119 1.739305 1.09586 ] [ 4.095572 1.356929 3.585425 ] [ 3.432411 4.018052 0.5968462 ] [ 4.864307 3.437474 2.341714 ] [ 3.124173 4.42761 2.898506 ] [ 3.279186 3.336979 4.610213 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.026325e-10 2.332401e-10 2.957561e-10 ] [ 3.78119e-10 1.739305e-10 1.09586e-10 ] [ 4.095572e-10 1.356929e-10 3.585425e-10 ] [ 3.432411e-10 4.018052e-10 5.968462e-11 ] [ 4.864307000000001e-10 3.437474e-10 2.341714e-10 ] [ 3.124173e-10 4.42761e-10 2.898506e-10 ] [ 3.279186e-10 3.336979e-10 4.610213e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.1294529 -4.576684 -4.6509557 ] [ -0.8690701 -6.6457286 -3.5782009 ] [ 4.9669927 -4.8369532 1.9341864 ] [ -3.1645455 3.5016173 -11.6706172 ] [ 14.5804691 -2.2733214 2.1376428 ] [ -7.854218 18.7638774 -3.6346798 ] [ 2.4698247 -3.9328075 19.4626243 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.622917275158354e-08 -7.332656166001656e-09 -7.451652548309113e-09 ] [ -1.392403807528043e-09 -1.064763107882553e-08 -5.73290987373777e-09 ] [ 7.95799964518857e-09 -7.749653396791529e-09 3.098908255880577e-09 ] [ -5.070160857329846e-09 5.610209419270167e-09 -1.869839018219851e-08 ] [ 2.336048690477901e-08 -3.642262428652167e-09 3.424881345998335e-09 ] [ -1.258384455794221e-08 3.006304593352066e-08 -5.823399047631793e-09 ] [ 3.95709542441606e-09 -6.301052282519955e-09 3.118256188978061e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -4.9540841 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.937317787890919e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.310676 3.0636498 2.1384353 ] [ 3.3476265 2.2335329 0.9413711 ] [ 5.3860463 1.7093803 4.2742537 ] [ 3.4867532 3.4814182 -1.0984896 ] [ 4.8391408 3.3556577 2.494364 ] [ 2.91216 4.1883326 3.7208161 ] [ 3.3207611 2.6167785 5.6153746 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.310676e-10 3.0636498e-10 2.1384353e-10 ] [ 3.3476265e-10 2.2335329e-10 9.413711000000001e-11 ] [ 5.3860463e-10 1.7093803e-10 4.2742537e-10 ] [ 3.4867532e-10 3.4814182e-10 -1.0984896e-10 ] [ 4.8391408e-10 3.3556577e-10 2.494364e-10 ] [ 2.91216e-10 4.1883326e-10 3.7208161e-10 ] [ 3.3207611e-10 2.6167785e-10 5.615374600000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.92e-05 3.48e-05 -2.47e-05 ] [ 6.11e-05 -3e-07 -0.0001339 ] [ -2.68e-05 3.37e-05 6e-06 ] [ -6.14e-05 -3.45e-05 9.24e-05 ] [ 1.26e-05 -3.87e-05 2.28e-05 ] [ -1.91e-05 -1.5e-06 3.75e-05 ] [ 1.44e-05 6.5e-06 -1e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.076179137279999e-14 5.575574686319999e-14 -3.95737628598e-14 ] [ 9.789299233739998e-14 -4.806529901999999e-16 -2.145314512926e-13 ] [ -4.293833379119999e-14 5.399335256579999e-14 9.613059803999999e-15 ] [ -9.83736453276e-14 -5.527509387299999e-14 1.480411209816e-13 ] [ 2.01874255884e-14 -6.200423573579999e-14 3.65296272552e-14 ] [ -3.06015737094e-14 -2.403264951e-15 6.008162377499999e-14 ] [ 2.30713435296e-14 1.0414148121e-14 -1.602176634e-16 ] ] } "relaxed-potential-energy" { "source-value" -20.434231 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.273924744195845e-18 } }