{ "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" [ [ 2.528767 2.719521 3.332257 ] [ 2.679869 4.813542 3.129006 ] [ 6.091314 2.864553 1.221181 ] [ 3.782186 2.699172 1.048642 ] [ 4.900359 1.620716 3.350029 ] [ 4.704911 4.540373 1.710823 ] [ 4.562967 3.751533 4.052534 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.528767e-10 2.719521e-10 3.332257e-10 ] [ 2.679869e-10 4.813542e-10 3.129006e-10 ] [ 6.091314e-10 2.864553e-10 1.221181e-10 ] [ 3.782186e-10 2.699172e-10 1.048642e-10 ] [ 4.900359e-10 1.620716e-10 3.350029e-10 ] [ 4.704911e-10 4.540373e-10 1.710823e-10 ] [ 4.562967000000001e-10 3.751533e-10 4.052534e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.8188345 -5.8378064 0.3531492 ] [ -0.4088221 5.0963375 -1.1435625 ] [ 3.1702203 -1.9985858 0.6031379 ] [ -3.649123 -3.5814042 -1.2722762 ] [ -0.5658803 -0.4319982 -1.0684686 ] [ 0.0891025 5.9238301 1.0711395 ] [ 2.1833371 0.8296271 1.4568807 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.311917503013073e-09 -9.353197007895657e-09 5.658073965557926e-10 ] [ -6.550052160828114e-10 8.165232861477974e-09 -1.832189117018625e-09 ] [ 5.07925288929247e-09 -3.202087469804197e-09 9.663334504598284e-10 ] [ -5.846539605191981e-09 -5.738042126149463e-09 -2.038411199634311e-09 ] [ -9.066401943009101e-10 -6.921374219700588e-10 -1.711875425082692e-09 ] [ 1.42757943530985e-10 9.491022170005883e-09 1.716154678654443e-09 ] [ 3.498091685765321e-09 1.329209154553181e-09 2.334180216065563e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.26752406491639 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.606344694984174e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4235398 2.6320311 3.3143582 ] [ 2.698546 4.9898127 3.0291763 ] [ 6.1239799 2.8312215 1.4083116 ] [ 3.6091176 2.5308168 1.1095731 ] [ 5.0676156 1.5494563 3.1303536 ] [ 4.6921648 4.6959513 1.7751884 ] [ 4.6354092 3.7801201 4.0775108 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4235398e-10 2.6320311e-10 3.3143582e-10 ] [ 2.698546e-10 4.9898127e-10 3.0291763e-10 ] [ 6.1239799e-10 2.8312215e-10 1.4083116e-10 ] [ 3.6091176e-10 2.5308168e-10 1.1095731e-10 ] [ 5.0676156e-10 1.5494563e-10 3.1303536e-10 ] [ 4.6921648e-10 4.6959513e-10 1.7751884e-10 ] [ 4.6354092e-10 3.7801201e-10 4.0775108e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.97e-05 2.99e-05 -3.39e-05 ] [ 5.89e-05 -1.16e-05 1.7e-05 ] [ -0.0001196 2e-06 3.33e-05 ] [ 5.48e-05 -6.67e-05 7.16e-05 ] [ 1.05e-05 0.0001266 -4.13e-05 ] [ 2.67e-05 1.03e-05 8.9e-06 ] [ -6.1e-05 -9.04e-05 -5.56e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.75846460298e-14 4.790508135659999e-14 -5.431378789259999e-14 ] [ 9.436820374259999e-14 -1.85852489544e-14 2.723700277799999e-14 ] [ -1.916203254264e-13 3.204353268e-15 5.33524819122e-14 ] [ 8.779927954319999e-14 -1.068651814878e-13 1.147158469944e-13 ] [ 1.6822854657e-14 2.028355618644e-13 -6.61698949842e-14 ] [ 4.277811612779999e-14 1.65024193302e-14 1.42593720426e-14 ] [ -9.773277467399998e-14 -1.448367677136e-13 -8.908102085039999e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.14226006491639 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.906710516396036e-18 } }