{ "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" [ [ 0.5834212 0.4864796 1.920549 ] [ 1.105833 1.594471 0.5913636 ] [ 0.1509893 2.698828 2.704799 ] [ 2.461816 0.3168887 1.8618 ] [ 2.990224 2.253685 0.1987983 ] [ 2.155559 1.839196 2.850141 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.834212e-11 4.864796e-11 1.920549e-10 ] [ 1.105833e-10 1.594471e-10 5.913636000000001e-11 ] [ 1.509893e-11 2.698828e-10 2.704799e-10 ] [ 2.461816e-10 3.168887e-11 1.8618e-10 ] [ 2.990224e-10 2.253685e-10 1.987983e-11 ] [ 2.155559e-10 1.839196e-10 2.850141e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.2709321 -9.2933847 -15.4740089 ] [ -12.5181172 3.5657781 -7.8887539 ] [ -6.5595638 4.8118183 3.4500501 ] [ -5.2619782 -4.632671 16.7395076 ] [ 0.651861 1.7702918 -1.3877662 ] [ 20.4168661 3.7781673 4.5609712 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.240610938844248e-09 -1.488964369444042e-08 -2.479209528963113e-08 ] [ -2.005623471427436e-08 5.713006306780644e-09 -1.263917706582482e-08 ] [ -1.050957976300601e-08 7.7093827837976e-09 5.527589610808702e-09 ] [ -8.430618451199266e-09 -7.422357168058157e-09 2.681964772042392e-08 ] [ 1.044396454211309e-09 2.83632013395395e-09 -2.223446560776457e-09 ] [ 3.271142553542408e-08 6.05329131753106e-09 7.307481424782121e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.1069827 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.58011166397006e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.2610874 0.4377627 1.6415543 ] [ 0.6832546 1.8026171 -0.4089108 ] [ 0.0916296 2.3588326 3.2309683 ] [ 2.6492401 0.2217122 2.062732 ] [ 3.1251123 1.955116 0.3006398 ] [ 2.6375184 2.4135077 3.3004674 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.610874e-11 4.377627e-11 1.6415543e-10 ] [ 6.832546e-11 1.8026171e-10 -4.089108e-11 ] [ 9.162960000000002e-12 2.3588326e-10 3.2309683e-10 ] [ 2.6492401e-10 2.217122e-11 2.062732e-10 ] [ 3.1251123e-10 1.955116e-10 3.006398e-11 ] [ 2.6375184e-10 2.4135077e-10 3.3004674e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.25e-05 -1.07e-05 -9.8e-06 ] [ 1.8e-05 5.6e-06 -7.6e-06 ] [ 1.78e-05 -3.2e-06 7.5e-06 ] [ 1.04e-05 8.34e-05 -1.1e-06 ] [ -2.59e-05 -4.46e-05 -3.5e-06 ] [ -7.8e-06 -3.05e-05 1.46e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.002720776e-14 -1.714328984256e-14 -1.570133088384e-14 ] [ 2.88391791744e-14 8.972189076479999e-15 -1.217654231808e-14 ] [ 2.851874385024e-14 -5.126965186560001e-15 1.2016324656e-14 ] [ 1.666263685632e-14 1.3362153017472e-13 -1.76239428288e-15 ] [ -4.149637447872e-14 -7.145707728768e-14 -5.6076181728e-15 ] [ -1.249697764224e-14 -4.88663869344e-14 2.339177866368e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.685082 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.352809505493091e-18 } }