{ "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" [ [ 1.761721 1.020444 0.0090108 ] [ 0.5084234 2.183768 2.158754 ] [ 1.862989 0.5350959 1.816496 ] [ 0.5578759 0.1863455 0.8245653 ] [ 2.554812 2.767243 0.4680195 ] [ 2.723778 2.754915 2.18144 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.761721e-10 1.020444e-10 9.010799999999999e-13 ] [ 5.084234e-11 2.183768e-10 2.158754e-10 ] [ 1.862989e-10 5.350959e-11 1.816496e-10 ] [ 5.578759e-11 1.863455e-11 8.245652999999999e-11 ] [ 2.554812e-10 2.767243e-10 4.680195e-11 ] [ 2.723778e-10 2.754915e-10 2.18144e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.7976847 -0.8368288 -5.1286408 ] [ -1.7146256 1.1918026 0.6642373 ] [ 3.0720396 -1.7976071 3.9289024 ] [ -3.7364236 -1.4433892 -0.0206415 ] [ 1.0475742 2.674286 -1.9797501 ] [ 0.5337507 0.2117364 2.5358927 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.278031777109862e-09 -1.340747538972119e-09 -8.216988386241008e-09 ] [ -2.747133049745172e-09 1.909478262328654e-09 1.064225472723316e-09 ] [ 4.921950025291783e-09 -2.880084069004088e-09 6.29479557068501e-09 ] [ -5.986410537325371e-09 -2.312564430955215e-09 -3.30713287182432e-11 ] [ 1.678398891793263e-09 4.284678506532749e-09 -3.171909325246462e-09 ] [ 8.551628928756346e-10 3.392391098523571e-10 4.062947996797389e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.419207 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.829558648347571e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1073438 0.8194146 -0.3269803 ] [ 0.3327515 2.6460968 1.8088823 ] [ 2.5205708 0.146233 1.918232 ] [ 0.2844838 0.4217797 1.1508413 ] [ 2.1556048 3.0437344 0.3310512 ] [ 2.5688446 2.3705529 2.5762591 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1073438e-10 8.194146e-11 -3.269803e-11 ] [ 3.327515e-11 2.6460968e-10 1.8088823e-10 ] [ 2.5205708e-10 1.46233e-11 1.918232e-10 ] [ 2.844838e-11 4.217797e-11 1.1508413e-10 ] [ 2.1556048e-10 3.0437344e-10 3.310512e-11 ] [ 2.5688446e-10 2.3705529e-10 2.5762591e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.1e-06 -4.8e-06 -1.06e-05 ] [ -5e-06 2.5e-06 -1.3e-06 ] [ 6.6e-06 -6.9e-06 -1e-05 ] [ -1.96e-05 -1.57e-05 1.17e-05 ] [ 1.53e-05 1.24e-05 -6.4e-06 ] [ -3e-07 1.26e-05 1.67e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.96674752448e-15 -7.69044777984e-15 -1.698307218048e-14 ] [ -8.010883104e-15 4.005441552e-15 -2.08282960704e-15 ] [ 1.057436569728e-14 -1.105501868352e-14 -1.6021766208e-14 ] [ -3.140266176767999e-14 -2.515417294656e-14 1.874546646336e-14 ] [ 2.451330229824e-14 1.986699009792e-14 -1.025393037312e-14 ] [ -4.8065298624e-16 2.018742542208e-14 2.675634956736e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.930693 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.033031374014222e-18 } }