{ "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" [ [ -4.542917013837969e-09 -3.63448303006203e-09 4.183183181087662e-09 ] [ -4.587564068641492e-09 -3.246037871831664e-09 -5.953438863992942e-09 ] [ -6.839696800725063e-10 1.30425187816224e-10 6.235446943209026e-09 ] [ 1.267312574646062e-09 6.578785542381024e-10 -3.912375437974605e-09 ] [ 2.853674270239807e-09 2.024389894360996e-09 1.423299689358839e-09 ] [ 5.693464077883761e-09 4.067827265478373e-09 -1.976115511687982e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.891905 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.584857892617462e-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" [ [ 4.8065298624e-14 2.307134333952e-14 -1.68228545184e-14 ] [ 4.101572149248001e-14 8.8119714144e-15 2.467351996032e-14 ] [ 4.4059857072e-14 -1.490024257344e-14 -6.488815314240001e-14 ] [ -4.822551628608e-14 4.133615681664e-14 4.950725758272e-14 ] [ -7.946796039168e-14 1.490024257344e-14 -1.906590178752e-14 ] [ -5.44740051072e-15 -7.321947157056e-14 2.64359142432e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.930693 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.033031374014222e-18 } }