{ "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" [ [ 1.558502 1.467528 2.474942 ] [ 1.379624 2.873279 4.407553 ] [ 1.24144 3.597751 1.918679 ] [ 3.591005 1.301821 3.64335 ] [ 3.465479 3.687448 2.931727 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.558502e-10 1.467528e-10 2.474942e-10 ] [ 1.379624e-10 2.873279e-10 4.407553e-10 ] [ 1.24144e-10 3.597751e-10 1.918679e-10 ] [ 3.591005e-10 1.301821e-10 3.64335e-10 ] [ 3.465479e-10 3.687448e-10 2.931727e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9514963 -0.1318155 1.2343897 ] [ 3.3722233 -0.9992636 -3.7457739 ] [ 0.7893324 1.3303428 1.4189918 ] [ -1.9405179 2.5794809 0.4647744 ] [ -3.1725341 -2.7787446 0.6276181 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.524465126637703e-09 -2.111917123590624e-10 1.977710318296326e-09 ] [ 5.402897331377024e-09 -1.600996777936443e-09 -6.001391369382837e-09 ] [ 1.264649917319954e-09 2.13144413180961e-09 2.273475487066909e-09 ] [ -3.109052411623912e-09 4.132783991780143e-09 7.446506776263475e-10 ] [ -5.08295996371077e-09 -4.452039633294248e-09 1.005555046610916e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.846455 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.019534958595927e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.534815 1.3787101 2.4386973 ] [ 1.6189122 2.8327924 4.2087286 ] [ 1.2500449 3.6451119 2.0284767 ] [ 3.4595262 1.4413659 3.7338902 ] [ 3.3727517 3.6298467 2.9664581 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.534815e-10 1.3787101e-10 2.4386973e-10 ] [ 1.6189122e-10 2.832792400000001e-10 4.2087286e-10 ] [ 1.2500449e-10 3.6451119e-10 2.0284767e-10 ] [ 3.4595262e-10 1.4413659e-10 3.7338902e-10 ] [ 3.3727517e-10 3.6298467e-10 2.9664581e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5e-07 -6.38e-05 -2.52e-05 ] [ 2.2e-05 9.56e-05 1.07e-05 ] [ -4.33e-05 -1.55e-05 -2.15e-05 ] [ 3.1e-06 -7.18e-05 -2.93e-05 ] [ 1.87e-05 5.54e-05 6.53e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.010883104e-16 -1.0221886840704e-13 -4.037485084416e-14 ] [ 3.52478856576e-14 1.5316808494848e-13 1.714328984256e-14 ] [ -6.937424768064e-14 -2.48337376224e-14 -3.44467973472e-14 ] [ 4.96674752448e-15 -1.1503628137344e-13 -4.694377498944e-14 ] [ 2.996070280896e-14 8.876058479231999e-14 1.0462213333824e-13 ] ] } "relaxed-potential-energy" { "source-value" -20.467452 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.279247308174621e-18 } }