{ "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" [ [ 2.750115 2.05781 3.008489 ] [ 2.459373 1.512643 5.182306 ] [ 3.045421 4.403069 3.012822 ] [ 1.351279 3.64529 4.777489 ] [ 4.685264 1.369475 1.888704 ] [ 3.677702 3.202643 0.9471066 ] [ 3.576002 3.111527 4.892003 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.750115e-10 2.05781e-10 3.008489e-10 ] [ 2.459373e-10 1.512643e-10 5.182306e-10 ] [ 3.045421e-10 4.403069e-10 3.012822e-10 ] [ 1.351279e-10 3.64529e-10 4.777489e-10 ] [ 4.685264e-10 1.369475e-10 1.888704e-10 ] [ 3.677702e-10 3.202643e-10 9.471066000000001e-11 ] [ 3.576002e-10 3.111527e-10 4.892003e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2618223 -5.284009 -6.7682064 ] [ -5.697387 -11.0812676 5.4243202 ] [ -0.0223529 4.4875355 -2.262572 ] [ -6.2768441 3.8247842 1.6117003 ] [ 1.9196714 -2.1193119 -0.2263685 ] [ -0.2520947 1.9273364 -1.8091055 ] [ 11.5908296 8.2449324 4.0302318 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.021662205320138e-09 -8.465915753645706e-09 -1.084386214816926e-08 ] [ -9.128220326255356e-09 -1.775414802382126e-08 8.690719079774206e-09 ] [ -3.581329408213859e-11 7.189824522345506e-09 -3.625039991142648e-09 ] [ -1.005661295228076e-08 6.127979875332383e-09 2.58222856167079e-09 ] [ 3.075652662038067e-09 -3.395512006338144e-09 -3.62682321373629e-10 ] [ -4.039002378952398e-10 3.087933345937677e-09 -2.898506560540887e-09 ] [ 1.857055635379557e-08 1.320983804018954e-08 6.457143219563761e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.026941 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.606493058069659e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6407613 1.2176812 2.8528725 ] [ 2.4426551 1.6792719 5.1968381 ] [ 2.7875002 3.7141602 2.9639352 ] [ 1.1931254 3.9088194 4.9941008 ] [ 4.3418908 1.2835695 1.1915411 ] [ 4.3714149 3.6445828 1.1740326 ] [ 3.7678083 3.854372 5.3355992 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6407613e-10 1.2176812e-10 2.8528725e-10 ] [ 2.4426551e-10 1.6792719e-10 5.1968381e-10 ] [ 2.7875002e-10 3.7141602e-10 2.9639352e-10 ] [ 1.1931254e-10 3.9088194e-10 4.9941008e-10 ] [ 4.3418908e-10 1.2835695e-10 1.1915411e-10 ] [ 4.371414900000001e-10 3.6445828e-10 1.1740326e-10 ] [ 3.7678083e-10 3.854372e-10 5.3355992e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.08e-05 -1.7e-05 -5.28e-05 ] [ -1.39e-05 -9e-07 8.5e-06 ] [ -1.28e-05 -2.02e-05 -9.6e-06 ] [ -1.19e-05 2.26e-05 1.36e-05 ] [ -1.49e-05 1.5e-06 3.59e-05 ] [ -7.5e-06 1.17e-05 1.56e-05 ] [ 3.01e-05 2.3e-06 -1.11e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.93470403272e-14 -2.723700277799999e-14 -8.45949262752e-14 ] [ -2.22702552126e-14 -1.4419589706e-15 1.3618501389e-14 ] [ -2.05078609152e-14 -3.236396800679999e-14 -1.53808956864e-14 ] [ -1.90659019446e-14 3.62091919284e-14 2.17896022224e-14 ] [ -2.38724318466e-14 2.403264951e-15 5.751814116059999e-14 ] [ -1.2016324755e-14 1.87454666178e-14 2.49939554904e-14 ] [ 4.82255166834e-14 3.685006258199999e-15 -1.77841606374e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.865222 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.702106461562274e-18 } }