{ "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" [ [ 2.298469 1.653345 1.333865 ] [ 0.8562694 1.609736 3.078689 ] [ 0.6106735 3.571622 1.917701 ] [ 2.573163 3.601998 2.791817 ] [ 3.634663 1.831744 3.381139 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.298469e-10 1.653345e-10 1.333865e-10 ] [ 8.562694e-11 1.609736e-10 3.078689e-10 ] [ 6.106735e-11 3.571622e-10 1.917701e-10 ] [ 2.573163e-10 3.601998e-10 2.791817e-10 ] [ 3.634663e-10 1.831744e-10 3.381139e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 5.3855201 -7.0478628 -4.5070388 ] [ -11.9488473 -5.5627975 0.2061963 ] [ -3.3799715 3.0220388 4.0353696 ] [ 4.0852569 11.95588 -1.7717118 ] [ 5.8580418 -2.3672585 2.0371848 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.628554466157342e-09 -1.129192109779781e-08 -7.221072253891399e-09 ] [ -1.914416394729399e-08 -8.912584174173615e-09 3.303628938772542e-10 ] [ -5.41531136088593e-09 4.841839952401398e-09 6.465374882673925e-09 ] [ 6.545303149067274e-09 1.915543157490792e-08 -2.838595248142081e-09 ] [ 9.385617692955299e-09 -3.792766255337889e-09 3.263929885699962e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.1796811 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.696587395991417e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.5562441 0.7304023 1.3126118 ] [ 0.5498625 1.4818523 2.6413295 ] [ 0.6812724 3.7971601 2.4936654 ] [ 2.6352554 4.1836511 2.8567144 ] [ 3.5506035 2.0753793 3.19889 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5562441e-10 7.304022999999999e-11 1.3126118e-10 ] [ 5.498625e-11 1.4818523e-10 2.6413295e-10 ] [ 6.812724e-11 3.7971601e-10 2.4936654e-10 ] [ 2.6352554e-10 4.1836511e-10 2.8567144e-10 ] [ 3.5506035e-10 2.0753793e-10 3.19889e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.3e-06 1.48e-05 -1.4e-06 ] [ 1.35e-05 -3.32e-05 1.73e-05 ] [ -1.96e-05 4.21e-05 -1.88e-05 ] [ 2.5e-06 2.5e-06 3e-07 ] [ 2.4e-06 -2.63e-05 2.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.0828296242e-15 2.37122141832e-14 -2.2430472876e-15 ] [ 2.162938455899999e-14 -5.31922642488e-14 2.77176557682e-14 ] [ -3.140266202639999e-14 6.745163629139998e-14 -3.012092071919999e-14 ] [ 4.005441585e-15 4.005441585e-15 4.806529901999999e-16 ] [ 3.845223921599999e-15 -4.21372454742e-14 4.165659248399999e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.174815 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.790402748227271e-18 } }