{ "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" [ [ 0.5308739 0.2525778 2.81745 ] [ 0.4737551 1.568741 0.832487 ] [ 2.312512 2.941662 0.559243 ] [ 2.76942 1.516894 1.016982 ] [ 2.535548 1.814472 2.698768 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.308739e-11 2.525778e-11 2.81745e-10 ] [ 4.737551e-11 1.568741e-10 8.32487e-11 ] [ 2.312512e-10 2.941662e-10 5.592430000000001e-11 ] [ 2.76942e-10 1.516894e-10 1.016982e-10 ] [ 2.535548e-10 1.814472e-10 2.698768e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.526643 -0.9388078 3.2518211 ] [ -9.3968484 -4.6780288 -2.6461315 ] [ -44.6051157 172.0892162 -61.910827 ] [ 63.0288861 -173.9966898 -24.4276876 ] [ -9.553565 7.5243102 85.7328249 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.437751021079743e-10 -1.504135908584682e-09 5.209991741444139e-09 ] [ -1.505541081568189e-08 -7.49502837478908e-09 -4.239570024862435e-09 ] [ -7.146527354261902e-08 2.757173188874366e-07 -9.91920795937934e-08 ] [ 1.009834077444861e-07 -2.787734284941499e-07 -3.913746997292606e-08 ] [ -1.530649848829315e-08 1.205527389008697e-08 1.373591276899201e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 51.007303 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.17227083566617e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3095804 0.8946851 2.9967107 ] [ 0.5633975 1.2295317 0.5237576 ] [ 1.7930269 3.4969512 0.1730677 ] [ 3.172451 1.4085768 0.8886521 ] [ 2.7836532 1.064602 3.342742 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.095804e-11 8.946851000000001e-11 2.9967107e-10 ] [ 5.633975e-11 1.2295317e-10 5.237576000000001e-11 ] [ 1.7930269e-10 3.4969512e-10 1.730677e-11 ] [ 3.172451e-10 1.4085768e-10 8.886521e-11 ] [ 2.7836532e-10 1.064602e-10 3.342742e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.16e-05 2.14e-05 -7.7e-06 ] [ -5.3e-06 -7.9e-06 -3.28e-05 ] [ 1.48e-05 -2.76e-05 -7.9e-06 ] [ -6.1e-05 4.75e-05 2.7e-05 ] [ 2.99e-05 -3.34e-05 2.14e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.460701500928e-14 3.428657968511999e-14 -1.233675998016e-14 ] [ -8.491536090240001e-15 -1.265719530432e-14 -5.255139316223999e-14 ] [ 2.371221398784e-14 -4.422007473408001e-14 -1.265719530432e-14 ] [ -9.773277386880001e-14 7.610338948800001e-14 4.32587687616e-14 ] [ 4.790508096192e-14 -5.351269913472e-14 3.428657968511999e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.615343 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.501853748037294e-18 } }