{ "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" [ [ 2.101107 2.382088 1.155059 ] [ 1.870329 4.675053 0.5879216 ] [ 2.558831 4.133121 3.113399 ] [ 4.446179 2.802067 2.809564 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.101107e-10 2.382088e-10 1.155059e-10 ] [ 1.870329e-10 4.675053e-10 5.879216e-11 ] [ 2.558831e-10 4.133121e-10 3.113399e-10 ] [ 4.446179e-10 2.802067e-10 2.809564e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.2681224 1.0884093 1.2327848 ] [ 0.2194918 -0.5790237 1.1952526 ] [ -0.2558869 -0.3172924 -1.7518052 ] [ -1.2317274 -0.1920932 -0.6762323 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.031756061592786e-09 1.743823934321293e-09 1.975138985037603e-09 ] [ 3.516646304173094e-10 -9.27698235029113e-10 1.915005771670414e-09 ] [ -4.099760087489875e-10 -5.083584652375219e-10 -2.806701335635868e-09 ] [ -1.97344484347877e-09 -3.077672340546586e-10 -1.083443581289812e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.5959023 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.377215369974095e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6616803 2.300031 0.8137017 ] [ 1.673449 4.3699656 1.049315 ] [ 2.8264503 4.6960825 3.0193325 ] [ 3.8148664 2.62625 2.7835943 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6616803e-10 2.300031e-10 8.137017e-11 ] [ 1.673449e-10 4.3699656e-10 1.049315e-10 ] [ 2.8264503e-10 4.696082500000001e-10 3.0193325e-10 ] [ 3.8148664e-10 2.62625e-10 2.7835943e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.63e-05 2.16e-05 -2.36e-05 ] [ 5.3e-06 -4.95e-05 3.28e-05 ] [ 3.53e-05 4e-06 -1e-05 ] [ -5.7e-05 2.39e-05 8e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.611547891904e-14 3.460701500928e-14 -3.781136825088e-14 ] [ 8.491536090240001e-15 -7.930774272959999e-14 5.255139316223999e-14 ] [ 5.655683471424e-14 6.4087064832e-15 -1.6021766208e-14 ] [ -9.13240673856e-14 3.829202123712e-14 1.28174129664e-15 ] ] } "relaxed-potential-energy" { "source-value" -9.6673908 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.548886752389701e-18 } }