{ "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" [ [ 1.248369 0.1750326 1.959235 ] [ 0.2041437 1.690187 0.8451771 ] [ 0.5672117 2.337944 2.235934 ] [ 2.305261 0.0188332 0.1900716 ] [ 2.629759 0.4646214 2.471997 ] [ 1.518408 2.931316 1.102854 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.248369e-10 1.750326e-11 1.959235e-10 ] [ 2.041437e-11 1.690187e-10 8.451771e-11 ] [ 5.672117e-11 2.337944e-10 2.235934e-10 ] [ 2.305261e-10 1.88332e-12 1.900716e-11 ] [ 2.629759e-10 4.646214e-11 2.471997e-10 ] [ 1.518408e-10 2.931316e-10 1.102854e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -117.5149255 -32.9786728 -41.5715226 ] [ -82.1799164 -87.0341651 -84.0963716 ] [ -24.8013263 2.2649634 121.5143033 ] [ -3.1317012 -3.5028802 -13.0600022 ] [ 120.2569397 31.241132 57.6356211 ] [ 107.3709297 90.0096227 -40.422028 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.882796662311538e-07 -5.283765854517287e-08 -6.660492160077884e-08 ] [ -1.316667407553785e-07 -1.394441045340673e-07 -1.347372404716291e-07 ] [ -3.973610516269216e-08 3.628871406447679e-09 1.946873758400603e-07 ] [ -5.017538445971305e-09 -5.612232761903228e-09 -2.092443019243657e-08 ] [ 1.926728572762954e-07 5.005381129772675e-08 9.234244465170719e-08 ] [ 1.720271933189004e-07 1.44211313136969e-07 -6.476322822692297e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 82.967586 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.329287265734134e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.9750075 0.0987949 1.8962425 ] [ 0.2812042 1.5898367 -0.1590196 ] [ 1.1234717 2.4545001 3.0614153 ] [ 2.1860324 -0.6530658 -0.201445 ] [ 3.0955895 0.28076 3.275504 ] [ 0.8118471 3.8471082 0.9325715 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.750075e-11 9.87949e-12 1.8962425e-10 ] [ 2.812042e-11 1.5898367e-10 -1.590196e-11 ] [ 1.1234717e-10 2.4545001e-10 3.0614153e-10 ] [ 2.1860324e-10 -6.530658000000001e-11 -2.01445e-11 ] [ 3.0955895e-10 2.8076e-11 3.275504e-10 ] [ 8.118471e-11 3.8471082e-10 9.325715e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.7e-05 2.11e-05 1.24e-05 ] [ 1.5e-05 -5.45e-05 1.83e-05 ] [ 2.36e-05 -8.3e-06 -2.36e-05 ] [ 8.3e-06 6.1e-06 -2.79e-05 ] [ -2.58e-05 6.1e-06 5e-07 ] [ -4e-06 2.95e-05 2.05e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.72370025536e-14 3.380592669888e-14 1.986699009792e-14 ] [ 2.4032649312e-14 -8.731862583360001e-14 2.931983216064e-14 ] [ 3.781136825088e-14 -1.329806595264e-14 -3.781136825088e-14 ] [ 1.329806595264e-14 9.77327738688e-15 -4.470072772032e-14 ] [ -4.133615681664e-14 9.77327738688e-15 8.010883104e-16 ] [ -6.4087064832e-15 4.72642103136e-14 3.28446207264e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.251331 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.603750258508229e-18 } }