{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.599025 3.051266 5.123232 ] [ 1.56583 2.880417 3.388537 ] [ 2.27514 4.963397 2.856014 ] [ 3.509207 1.897473 3.301843 ] [ 3.336514 3.219201 1.422465 ] [ 4.208969 3.943636 3.692529 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.599025e-10 3.051266e-10 5.123232e-10 ] [ 1.56583e-10 2.880417e-10 3.388537e-10 ] [ 2.27514e-10 4.963397e-10 2.856014e-10 ] [ 3.509207e-10 1.897473e-10 3.301843e-10 ] [ 3.336514e-10 3.219201e-10 1.422465e-10 ] [ 4.208969e-10 3.943636e-10 3.692529e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.1844563 36.4994815 92.2235051 ] [ -38.3908056 -19.5027902 -31.2719129 ] [ -3.7591681 8.8520125 -9.7734609 ] [ 12.3822798 -48.5337249 -56.3575656 ] [ -4.5865578 -4.9098988 -33.8876864 ] [ 33.1697955 27.5949199 39.0671206 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.897708207854094e-09 5.847861641241527e-08 1.477583449767998e-07 ] [ -6.150885169275635e-08 -3.124691475624418e-08 -5.010312814886317e-08 ] [ -6.022851293098175e-09 1.418248759137592e-08 -1.565881068729261e-08 ] [ 1.983859937121019e-08 -7.775959999576398e-08 -9.029477475344219e-08 ] [ -7.348475737650443e-09 -7.866525132664639e-09 -5.429405933039957e-08 ] [ 5.314387130465834e-08 4.421193588088162e-08 6.259242778298006e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 35.017697 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.610453590989189e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.836175 2.9152311 5.7442795 ] [ 0.8687133 2.8563163 3.6350338 ] [ 2.039557 5.0572905 2.4259687 ] [ 3.3725526 1.4092749 3.0463331 ] [ 3.8882876 3.3511544 1.0136587 ] [ 4.4893995 4.3661227 3.9193461 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.836175e-10 2.9152311e-10 5.7442795e-10 ] [ 8.687133000000001e-11 2.8563163e-10 3.6350338e-10 ] [ 2.039557e-10 5.0572905e-10 2.4259687e-10 ] [ 3.3725526e-10 1.4092749e-10 3.0463331e-10 ] [ 3.8882876e-10 3.3511544e-10 1.0136587e-10 ] [ 4.4893995e-10 4.3661227e-10 3.9193461e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.86e-05 -3.6e-06 3.59e-05 ] [ 2.23e-05 -2.19e-05 -1.03e-05 ] [ 1.98e-05 -2.5e-06 -1.25e-05 ] [ -2.1e-05 -7.8e-06 -5.8e-06 ] [ -2.7e-05 6e-06 -2.04e-05 ] [ 2.45e-05 2.97e-05 1.3e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.98004853924e-14 -5.767835882399999e-15 5.751814116059999e-14 ] [ 3.572853893819999e-14 -3.50876682846e-14 -1.65024193302e-14 ] [ 3.17230973532e-14 -4.005441585e-15 -2.0027207925e-14 ] [ -3.364570931399999e-14 -1.24969777452e-14 -9.2926244772e-15 ] [ -4.325876911799999e-14 9.613059803999999e-15 -3.26844033336e-14 ] [ 3.925332753299999e-14 4.75846460298e-14 2.082829624199999e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.444463 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.474475774327754e-18 } }