{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0909404 0.3504436 2.335509 ] [ 2.174921 0.6476227 0.0631824 ] [ 2.07151 0.3484765 2.894541 ] [ 2.345183 1.577217 1.820601 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.09404e-12 3.504436000000001e-11 2.335509e-10 ] [ 2.174921e-10 6.476227e-11 6.31824e-12 ] [ 2.07151e-10 3.484765e-11 2.894541e-10 ] [ 2.345183e-10 1.577217e-10 1.820601e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.6460836 -0.9573065 -0.1290589 ] [ -0.164246 -1.1117999 -4.8537891 ] [ -1.9295863 -16.9883873 17.4600871 ] [ 5.7399159 19.0574937 -12.4772392 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.841669901402299e-09 -1.533774093239875e-09 -2.067751522861651e-10 ] [ -2.631511012599168e-10 -1.781299806787778e-09 -7.776627418313874e-09 ] [ -3.091538057675975e-09 -2.721839695715563e-08 2.797414334875167e-08 ] [ 9.19635906033819e-09 3.053347085718328e-08 -1.999074093836929e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -0.51071776 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.182600548993454e-20 } "relaxed-configuration-positions" { "source-value" [ [ -0.4920574 -0.2974735 3.700181 ] [ 3.096881 1.4344483 -0.8500508 ] [ 1.3876355 0.5792543 2.9612347 ] [ 2.6900952 1.2075307 1.3024684 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.920574e-11 -2.974735e-11 3.700181e-10 ] [ 3.096881e-10 1.4344483e-10 -8.500508e-11 ] [ 1.3876355e-10 5.792543e-11 2.9612347e-10 ] [ 2.6900952e-10 1.2075307e-10 1.3024684e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.1949226 0.0896034 -0.0041987 ] [ 0.0041659 -0.0037113 0.2993322 ] [ -0.2702251 -0.1259181 0.0959446 ] [ 0.0711366 0.040026 -0.3910782 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.123004325855501e-10 1.435604726241907e-10 -6.727058977752959e-12 ] [ 6.67450758459072e-12 -5.94615809277504e-12 4.795830526926298e-10 ] [ -4.329483375733421e-10 -2.017430359555565e-10 1.537201950120077e-10 ] [ 1.139733974032013e-10 6.41287214241408e-11 -6.265763489445466e-10 ] ] } "relaxed-potential-energy" { "source-value" -8.3789607 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.3424574940142e-18 } }