{ "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" [ [ 2.301375 1.527111 2.019819 ] [ 1.794175 5.106546 1.47688 ] [ 0.9503771 3.237781 1.232452 ] [ 3.392468 3.669062 0.7528338 ] [ 3.101246 3.595776 2.776891 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.301375e-10 1.527111e-10 2.019819e-10 ] [ 1.794175e-10 5.106546e-10 1.47688e-10 ] [ 9.503771e-11 3.237781e-10 1.232452e-10 ] [ 3.392468e-10 3.669062e-10 7.528338e-11 ] [ 3.101246e-10 3.595776e-10 2.776891e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.1872986 8.2854672 -1.7234868 ] [ -4.5242589 10.2649683 -2.7068952 ] [ 2.8319719 -9.9707859 2.4844727 ] [ 3.4378106 -1.1551014 -6.3640673 ] [ 2.4417751 -7.4245482 8.3099766 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.708791921228571e-09 1.327478184024524e-08 -2.761330257217405e-09 ] [ -7.248661836026326e-09 1.644629222351312e-08 -4.33692420439574e-09 ] [ 4.537319168942556e-09 -1.597496005998229e-08 3.980564074955852e-09 ] [ 5.507979770058421e-09 -1.850676457733349e-09 -1.019635984125778e-08 ] [ 3.912154978471582e-09 -1.189543754604272e-08 1.331405022791507e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -6.3970896 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.024926739828283e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.885353 1.759247 2.4089655 ] [ 1.6012153 4.8932328 0.710701 ] [ 0.4807134 3.1003699 1.3542531 ] [ 3.6983742 4.6601697 1.3676998 ] [ 3.8739852 2.7232566 2.4172565 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.885353e-10 1.759247e-10 2.4089655e-10 ] [ 1.6012153e-10 4.8932328e-10 7.10701e-11 ] [ 4.807134e-11 3.1003699e-10 1.3542531e-10 ] [ 3.6983742e-10 4.660169700000001e-10 1.3676998e-10 ] [ 3.8739852e-10 2.7232566e-10 2.4172565e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.6e-06 -1.97e-05 -1.3e-06 ] [ -1.52e-05 2.13e-05 3e-06 ] [ -4.47e-05 -1.02e-05 -1.1e-05 ] [ 3.48e-05 1.31e-05 -2.21e-05 ] [ 3.07e-05 -4.6e-06 3.14e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.972189076479999e-15 -3.156287942976e-14 -2.08282960704e-15 ] [ -2.435308463616e-14 3.412636202304e-14 4.8065298624e-15 ] [ -7.161729494976001e-14 -1.634220153216e-14 -1.76239428288e-14 ] [ 5.575574640383999e-14 2.098851373248e-14 -3.540810331968e-14 ] [ 4.918682225856e-14 -7.370012455680001e-15 5.030834589312e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.370748 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.821794660660836e-18 } }