{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.047673 1.456203 2.59416 ] [ 0.648425 2.408552 0.8864435 ] [ 2.028254 0.9559849 0.3097335 ] [ 1.556479 0.0798405 1.221415 ] [ 2.621496 2.506538 1.825694 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.047673e-10 1.456203e-10 2.59416e-10 ] [ 6.48425e-11 2.408552e-10 8.864435000000001e-11 ] [ 2.028254e-10 9.559849e-11 3.097335e-11 ] [ 1.556479e-10 7.98405e-12 1.221415e-10 ] [ 2.621496e-10 2.506538e-10 1.825694e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.6005818 -2.1108849 13.7851568 ] [ -20.7880606 10.5238083 -9.2198039 ] [ 33.8433288 42.7546966 -64.5958256 ] [ -27.4618846 -61.9159245 51.7123421 ] [ 21.0071982 10.7483046 8.3181305 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.057529793076566e-08 -3.382010463843426e-09 2.208625612098621e-08 ] [ -3.330614495949602e-08 1.686099975895526e-08 -1.477175437864207e-08 ] [ 5.422299062013926e-08 6.850057588627925e-08 -1.03493922430259e-07 ] [ -4.399878983172444e-08 -9.920024750640813e-08 8.285230620203449e-08 ] [ 3.365724210184686e-08 1.722068248523472e-08 1.332711432566274e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 23.965276 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.839660523456098e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.9481729 1.5324673 2.7587238 ] [ -0.0127448 2.5900935 0.5670617 ] [ 2.1283731 1.1063437 0.1534457 ] [ 1.5866728 -0.3736455 1.3060306 ] [ 3.251853 2.5518594 2.0521843 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.481729e-11 1.5324673e-10 2.7587238e-10 ] [ -1.27448e-12 2.5900935e-10 5.670617e-11 ] [ 2.1283731e-10 1.1063437e-10 1.534457e-11 ] [ 1.5866728e-10 -3.736455e-11 1.3060306e-10 ] [ 3.251853e-10 2.5518594e-10 2.0521843e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.46e-05 -3.4e-05 1.56e-05 ] [ 2.16e-05 4.71e-05 2.15e-05 ] [ 4.2e-05 5.89e-05 -0.0001613 ] [ -1.38e-05 -9.46e-05 0.0001208 ] [ -1.52e-05 2.26e-05 3.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.54353115364e-14 -5.447400555599999e-14 2.49939554904e-14 ] [ 3.46070152944e-14 7.546251946139999e-14 3.4446797631e-14 ] [ 6.729141862799998e-14 9.436820374259999e-14 -2.584310910642e-13 ] [ -2.21100375492e-14 -1.515659095764e-13 1.935429373872e-13 ] [ -2.43530848368e-14 3.62091919284e-14 5.4474005556e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.64318 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.865443094145612e-18 } }