{ "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" [ [ 2.930378 5.180054 2.851976 ] [ 5.738994 3.052967 1.218676 ] [ 3.217774 2.94037 2.40806 ] [ 5.439965 2.572298 3.526756 ] [ 4.050256 4.656384 1.057411 ] [ 5.133306 4.977378 3.451883 ] [ 3.497867 4.079859 4.731393 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.930378e-10 5.180054e-10 2.851976e-10 ] [ 5.738994e-10 3.052967000000001e-10 1.218676e-10 ] [ 3.217774e-10 2.94037e-10 2.40806e-10 ] [ 5.439965e-10 2.572298e-10 3.526756e-10 ] [ 4.050256e-10 4.656384e-10 1.057411e-10 ] [ 5.133306e-10 4.977378e-10 3.451883e-10 ] [ 3.497867e-10 4.079859e-10 4.731393e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.3123481 -3.2931927 2.99397 ] [ -5.7283046 2.644356 5.9007701 ] [ 8.0063339 7.146204 2.9608755 ] [ -5.9515174 7.3222456 -4.5587451 ] [ 3.8502177 -5.0902847 3.9603307 ] [ -5.1232322 -6.912645 -4.4492284 ] [ 2.6341545 -1.8166832 -6.8079728 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.704790064971301e-09 -5.276276351729228e-09 4.796868737376576e-09 ] [ -9.177755706941095e-09 4.236725360272205e-09 9.454075898935677e-09 ] [ 1.282756099289849e-08 1.144948097626744e-08 4.743845503199511e-09 ] [ -9.535382036564404e-09 1.173153071207567e-08 -7.303914819406559e-09 ] [ 6.168728783930348e-09 -8.155535139555942e-09 6.3451492581765e-09 ] [ -8.208322853769751e-09 -1.107527820689002e-08 -7.128449723079391e-09 ] [ 4.220380755475114e-09 -2.91064735044013e-09 -1.090757485520231e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -39.109806 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.266081681722357e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8947337 5.1927076 2.9094065 ] [ 5.5380803 3.1670495 1.5494024 ] [ 3.5293964 3.128799 2.4596386 ] [ 5.2884167 2.6236468 3.6906855 ] [ 4.0587021 4.7548154 1.0665444 ] [ 5.0444722 4.7167178 3.0392624 ] [ 3.6547386 3.8755739 4.5312152 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.894733700000001e-10 5.192707600000001e-10 2.9094065e-10 ] [ 5.5380803e-10 3.1670495e-10 1.5494024e-10 ] [ 3.5293964e-10 3.128799e-10 2.4596386e-10 ] [ 5.2884167e-10 2.6236468e-10 3.6906855e-10 ] [ 4.0587021e-10 4.7548154e-10 1.0665444e-10 ] [ 5.044472200000001e-10 4.7167178e-10 3.0392624e-10 ] [ 3.6547386e-10 3.8755739e-10 4.5312152e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.36e-05 -5.1e-06 -6.9e-06 ] [ 2.89e-05 -1.84e-05 -3.83e-05 ] [ -1.5e-06 3.04e-05 0.0001116 ] [ -4.55e-05 3.69e-05 7.7e-06 ] [ 2.1e-05 6.5e-06 4.3e-05 ] [ -1.04e-05 7e-07 -2.08e-05 ] [ 2.12e-05 -5.11e-05 -9.63e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.178960204288e-14 -8.17110076608e-15 -1.105501868352e-14 ] [ 4.630290434112001e-14 -2.948004982272e-14 -6.136336457664001e-14 ] [ -2.4032649312e-15 4.870616927232e-14 1.7880291088128e-13 ] [ -7.28990362464e-14 5.912031730752001e-14 1.233675998016e-14 ] [ 3.36457090368e-14 1.04141480352e-14 6.889359469439999e-14 ] [ -1.666263685632e-14 1.12152363456e-15 -3.332527371264e-14 ] [ 3.396614436096001e-14 -8.187122532288001e-14 -1.5428960858304e-13 ] ] } "relaxed-potential-energy" { "source-value" -52.328123 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.383889528094676e-18 } }