{ "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" [ [ 2.539099 2.604661 3.099024 ] [ 2.611969 4.601789 1.586924 ] [ 4.376067 2.909228 1.297188 ] [ 4.596034 1.971363 3.954157 ] [ 4.509814 4.398854 3.387028 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.539099e-10 2.604661e-10 3.099024e-10 ] [ 2.611969e-10 4.601789e-10 1.586924e-10 ] [ 4.376067e-10 2.909228e-10 1.297188e-10 ] [ 4.596034e-10 1.971363e-10 3.954157e-10 ] [ 4.509814000000001e-10 4.398854e-10 3.387028e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2516538 0.1545805 -0.3697548 ] [ 0.9016065 -0.854205 0.7444402 ] [ -0.3423012 0.2535792 0.95369 ] [ -0.0933582 1.0254079 -0.8860563 ] [ -0.2142934 -0.5793626 -0.4423191 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.031938382173091e-10 2.47665265172037e-10 -5.924125008693431e-10 ] [ 1.444532867362521e-09 -1.36858729164597e-09 1.192724693850287e-09 ] [ -5.484269844301607e-10 4.062786691084128e-10 1.52797983407946e-09 ] [ -1.495763266322988e-10 1.642884577699008e-09 -1.419618700268494e-09 ] [ -3.433358783004156e-10 -9.282412203334881e-10 -7.086733267919093e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -13.788425 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.209149235466145e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3386422 2.3090494 2.7718666 ] [ 2.7126778 4.5257323 2.050947 ] [ 4.3528662 2.8055975 1.4782836 ] [ 4.4273816 2.3144166 3.8720709 ] [ 4.8014152 4.5310991 3.1511529 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3386422e-10 2.3090494e-10 2.7718666e-10 ] [ 2.7126778e-10 4.5257323e-10 2.050947e-10 ] [ 4.3528662e-10 2.8055975e-10 1.4782836e-10 ] [ 4.4273816e-10 2.3144166e-10 3.8720709e-10 ] [ 4.8014152e-10 4.5310991e-10 3.1511529e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.1e-06 5.7e-06 3.4e-06 ] [ 2.4e-06 -6.1e-06 5.8e-06 ] [ 5.4e-06 1.2e-06 -2.2e-06 ] [ -6.6e-06 5.6e-06 -4.8e-06 ] [ -5.3e-06 -6.3e-06 -2.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.568924199399999e-15 9.1324068138e-15 5.4474005556e-15 ] [ 3.845223921599999e-15 -9.773277467399999e-15 9.2926244772e-15 ] [ 8.6517538236e-15 1.9226119608e-15 -3.5247885948e-15 ] [ -1.05743657844e-14 8.972189150399999e-15 -7.690447843199998e-15 ] [ -8.4915361602e-15 -1.00937127942e-14 -3.685006258199999e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.50509 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.323971627206706e-18 } }