{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 5.983874e-11 2.193689e-11 4.397528e-11 ] [ 8.35664e-12 1.4883887e-10 2.3456035e-10 ] [ 1.687887e-10 2.2633125e-10 8.180086e-11 ] ] "source-value" [ [ 0.5983874 0.2193689 0.4397528 ] [ 0.0835664 1.4883887 2.3456035 ] [ 1.687887 2.2633125 0.8180086 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.8040508750208e-13 7.855471971782402e-13 4.796916802675201e-13 ] [ 6.586548088108801e-13 1.44195895872e-14 -9.1051697360064e-13 ] [ -8.3905989631296e-13 -7.999667867654401e-13 4.3066507567104e-13 ] ] "source-value" [ [ 0.0001126 0.0004903 0.0002994 ] [ 0.0004111 9e-06 -0.0005683 ] [ -0.0005237 -0.0004993 0.0002688 ] ] } "species" { "source-value" [ "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -9.764296065396782e-19 "source-value" -6.0943943 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.3163883660648e-10 2.242068178987029e-09 1.906673491936282e-09 ] [ 7.358497612306311e-10 -8.324544425407257e-10 -1.808679403060629e-09 ] [ -8.67488597837111e-10 -1.409613736446303e-09 -9.799408887565248e-11 ] ] "source-value" [ [ 0.0821625 1.3993889 1.190052 ] [ 0.4592813 -0.5195772 -1.1288889 ] [ -0.5414438 -0.8798117 -0.0611631 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -8.166559716883667e-19 "source-value" -5.0971657 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 7.670006e-11 2.532507e-12 2.22375e-12 ] [ 6.685316e-12 1.820216e-10 2.678565e-10 ] [ 1.535987e-10 2.125529e-10 9.025624000000001e-11 ] ] "source-value" [ [ 0.7670006 0.02532507 0.0222375 ] [ 0.06685316 1.820216 2.678565 ] [ 1.535987 2.125529 0.9025624 ] ] } "instance-id" 1 }