{ "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" [ [ -24.6818781 -21.3786726 -0.1374359 ] [ -20.0843937 -11.5127008 -25.8829641 ] [ -11.4092449 8.9464106 36.5656143 ] [ 4.2457513 -3.5304717 -10.1902913 ] [ 30.3829376 2.5197648 15.817608 ] [ 21.5468279 24.9556697 -16.172531 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.954472804925553e-08 -3.425240942345755e-08 -2.201965858386067e-10 ] [ -3.217874602908281e-08 -1.844538006402546e-08 -4.146907995802571e-08 ] [ -1.827962543976163e-08 1.43337299033973e-08 5.858457235665016e-08 ] [ 6.802443470591208e-09 -5.656439218136031e-09 -1.632664648000164e-08 ] [ 4.867883229394526e-08 4.037108252474788e-09 2.534260173457905e-08 ] [ 3.452182391378116e-08 3.998339054974695e-08 -2.591125106736324e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 21.558923 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.45412024002274e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.2435604 0.4544937 2.1504624 ] [ 0.5362427 1.1022043 0.0452602 ] [ 1.3460535 1.9378703 3.0061623 ] [ 2.6013315 0.1859635 0.2288743 ] [ 3.1790436 0.7821206 2.3411956 ] [ 1.0540414 3.1552818 1.0333138 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.435604e-11 4.544937e-11 2.1504624e-10 ] [ 5.362427e-11 1.1022043e-10 4.52602e-12 ] [ 1.3460535e-10 1.9378703e-10 3.006162300000001e-10 ] [ 2.6013315e-10 1.859635e-11 2.288743e-11 ] [ 3.1790436e-10 7.821206000000001e-11 2.3411956e-10 ] [ 1.0540414e-10 3.1552818e-10 1.0333138e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.6e-06 1.9e-06 1.9e-06 ] [ 1.29e-05 -2.62e-05 -2.69e-05 ] [ 3.7e-06 -1.11e-05 2.21e-05 ] [ -3.11e-05 2.36e-05 1.75e-05 ] [ 5.7e-06 8.6e-06 -1.14e-05 ] [ 1.43e-05 3.3e-06 -3.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.972189076479999e-15 3.04413557952e-15 3.04413557952e-15 ] [ 2.066807840832e-14 -4.197702746496e-14 -4.309855109952001e-14 ] [ 5.928053496960001e-15 -1.778416049088e-14 3.540810331968e-14 ] [ -4.982769290688e-14 3.781136825088e-14 2.8038090864e-14 ] [ 9.13240673856e-15 1.377871893888e-14 -1.826481347712e-14 ] [ 2.291112567744e-14 5.28718284864e-15 -5.126965186560001e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.433831 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.831901671437829e-18 } }