{ "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" [ [ -2.8354658 -2.2684659 2.6109376 ] [ -2.8633323 -2.0260175 -3.7158443 ] [ -0.4269003 0.081405 3.8918599 ] [ 0.7909943 0.4106155 -2.4419127 ] [ 1.7811234 1.2635248 0.8883538 ] [ 3.5535808 2.5389381 -1.2333943 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.542917051266116e-09 -3.63448306000578e-09 4.183183215552038e-09 ] [ -4.587564106437478e-09 -3.246037898575094e-09 -5.953438913042085e-09 ] [ -6.839696857075902e-10 1.3042518889077e-10 6.235446994581576e-09 ] [ 1.267312585087186e-09 6.57878559658227e-10 -3.912375470207851e-09 ] [ 2.853674293750635e-09 2.024389911039523e-09 1.423299701085109e-09 ] [ 5.693464124791026e-09 4.067827298992355e-09 -1.976115527968786e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.891905 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.584857905674777e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.0932308 0.1110883 1.8575462 ] [ 0.5278646 1.4046325 -0.0925131 ] [ 1.0777887 1.7540623 3.1668288 ] [ 2.1386367 -0.1712092 0.6736748 ] [ 3.1231971 1.4717561 1.9829668 ] [ 1.5124346 3.0476042 1.2167653 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.32308e-12 1.110883e-11 1.8575462e-10 ] [ 5.278646e-11 1.4046325e-10 -9.25131e-12 ] [ 1.0777887e-10 1.7540623e-10 3.1668288e-10 ] [ 2.1386367e-10 -1.712092e-11 6.736748e-11 ] [ 3.1231971e-10 1.4717561e-10 1.9829668e-10 ] [ 1.5124346e-10 3.0476042e-10 1.2167653e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3e-05 1.44e-05 -1.05e-05 ] [ 2.56e-05 5.5e-06 1.54e-05 ] [ 2.75e-05 -9.3e-06 -4.05e-05 ] [ -3.01e-05 2.58e-05 3.09e-05 ] [ -4.96e-05 9.3e-06 -1.19e-05 ] [ -3.4e-06 -4.57e-05 1.65e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.806529901999999e-14 2.30713435296e-14 -1.6822854657e-14 ] [ 4.10157218304e-14 8.811971486999999e-15 2.46735201636e-14 ] [ 4.4059857435e-14 -1.49002426962e-14 -6.4888153677e-14 ] [ -4.82255166834e-14 4.133615715719999e-14 4.950725799059999e-14 ] [ -7.94679610464e-14 1.49002426962e-14 -1.90659019446e-14 ] [ -5.4474005556e-15 -7.32194721738e-14 2.6435914461e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.930693 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.033031399002736e-18 } }