{ "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" [ [ 2.0273653 -1.8454004 -5.5070216 ] [ -3.1541305 -3.2536563 4.9154498 ] [ -6.1128174 2.890118 -4.0811858 ] [ 3.2106512 6.9518513 2.0592008 ] [ 4.0289315 -4.7429127 2.6135569 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.2481973122424e-09 -2.956657401254253e-09 -8.823221330453293e-09 ] [ -5.053474187686736e-09 -5.212932098926894e-09 7.875418815159973e-09 ] [ -9.793813206188631e-09 4.630479529102812e-09 -6.538780527772596e-09 ] [ 5.14403033256406e-09 1.113809371590252e-08 3.299203406474107e-09 ] [ 6.45505990928657e-09 -7.59898390504185e-09 4.187379796809474e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.1552416 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.861784268144773e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.2321029 1.4942638 2.0436092 ] [ -0.2042804 1.2110837 2.5098211 ] [ 0.5686028 3.5579476 2.1957544 ] [ 2.9930193 3.985306 2.5582323 ] [ 4.3837934 2.0198439 3.195794 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2321029e-10 1.4942638e-10 2.0436092e-10 ] [ -2.042804e-11 1.2110837e-10 2.5098211e-10 ] [ 5.686028e-11 3.5579476e-10 2.1957544e-10 ] [ 2.9930193e-10 3.985306e-10 2.5582323e-10 ] [ 4.3837934e-10 2.0198439e-10 3.195794e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.63e-05 2.1e-06 6.7e-06 ] [ -9.1e-06 -8.9e-06 3e-06 ] [ 2.94e-05 -1.5e-06 2e-06 ] [ -6e-07 -5e-07 4.3e-06 ] [ -3.6e-05 8.9e-06 -1.59e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.61154791342e-14 3.364570931399999e-15 1.07345834478e-14 ] [ -1.45798073694e-14 -1.42593720426e-14 4.806529901999999e-15 ] [ 4.710399303959999e-14 -2.403264951e-15 3.204353268e-15 ] [ -9.613059803999998e-16 -8.010883169999999e-16 6.8893595262e-15 ] [ -5.7678358824e-14 1.42593720426e-14 -2.54746084806e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.346148 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.657635657750583e-18 } }