{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.8327452e-10 1.514268e-10 2.7911059e-10 ] [ 3.6841537e-10 1.575949e-11 1.90461e-10 ] [ 4.0648221e-10 2.5124951e-10 2.5117781e-10 ] ] "source-value" [ [ 1.8327452 1.514268 2.7911059 ] [ 3.6841537 0.1575949 1.90461 ] [ 4.0648221 2.5124951 2.5117781 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -3.95561385909312e-12 3.64959812452032e-12 2.11903879867008e-12 ] [ 5.74156013829888e-12 3.74620937475456e-12 -3.652962695424e-13 ] [ -1.78594627920576e-12 -7.39580749927488e-12 -1.75374252912768e-12 ] ] "source-value" [ [ -0.0024689 0.0022779 0.0013226 ] [ 0.0035836 0.0023382 -0.000228 ] [ -0.0011147 -0.0046161 -0.0010946 ] ] } "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" -1.250700790875686e-18 "source-value" -7.8062604 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 6.727119059376241e-09 -9.801817279461635e-09 -4.681474049093064e-09 ] [ -1.008528830615017e-08 1.102506182593493e-08 5.918510452353528e-09 ] [ 3.358169246773932e-09 -1.223244546473295e-09 -1.237036403260466e-09 ] ] "source-value" [ [ 4.1987375 -6.1178132 -2.9219463 ] [ -6.2947419 6.8813024 3.6940437 ] [ 2.0960044 -0.7634892 -0.7720974 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -9.825385457771265e-19 "source-value" -6.1325233 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.89741e-10 1.753889e-10 2.846167e-10 ] [ 3.867988e-10 4.330001e-12 1.822705e-10 ] [ 3.816323e-10 2.387169e-10 2.538622e-10 ] ] "source-value" [ [ 1.89741 1.753889 2.846167 ] [ 3.867988 0.04330001 1.822705 ] [ 3.816323 2.387169 2.538622 ] ] } "instance-id" 1 }