{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.3142934 0.7540522 2.32218 ] [ 0.538251 2.820956 1.392978 ] [ 2.532298 0.1763292 2.432177 ] [ 1.796653 2.418536 0.8624239 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.142934e-11 7.540522e-11 2.32218e-10 ] [ 5.38251e-11 2.820956e-10 1.392978e-10 ] [ 2.532298e-10 1.763292e-11 2.432177e-10 ] [ 1.796653e-10 2.418536e-10 8.624239e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.4481601 -1.6319013 4.020223 ] [ -298.9536236 93.0876902 126.869384 ] [ 6.0614008 4.3649918 -4.2345139 ] [ 306.3403829 -95.8207807 -126.6550932 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.15463278825111e-08 -2.614594131854224e-09 6.441107354069381e-09 ] [ -4.789765103815509e-07 1.491429221514708e-07 2.032671626147734e-07 ] [ 9.711434731068908e-09 6.993487869561601e-09 -6.78443922692821e-09 ] [ 4.908114035329931e-07 -1.535218158891781e-07 -2.029238309021322e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 75.755033 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.213729437804989e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.0622699 0.677073 2.6892322 ] [ 0.1219465 2.8227316 1.3905429 ] [ 2.4687785 0.2621611 2.1142662 ] [ 2.5285005 2.4079077 0.8157177 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.226990000000001e-12 6.770730000000001e-11 2.6892322e-10 ] [ 1.219465e-11 2.8227316e-10 1.3905429e-10 ] [ 2.4687785e-10 2.621611e-11 2.1142662e-10 ] [ 2.5285005e-10 2.4079077e-10 8.157177e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.88e-05 -2.34e-05 -1.38e-05 ] [ -2.32e-05 3.7e-05 7.2e-06 ] [ -4.5e-06 2.16e-05 1e-05 ] [ 8.9e-06 -3.52e-05 -3.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.012092071919999e-14 -3.749093323559999e-14 -2.21100375492e-14 ] [ -3.71704979088e-14 5.9280535458e-14 1.15356717648e-14 ] [ -7.209794853e-15 3.46070152944e-14 1.602176634e-14 ] [ 1.42593720426e-14 -5.63966175168e-14 -5.4474005556e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.092648 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.937455806878683e-18 } }