{ "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" [ [ 0.8670835 0.0748596 0.0624467 ] [ 1.077368 0.92169 1.864842 ] [ 2.976718 2.979813 0.7013645 ] [ 1.541867 2.360612 1.695051 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.670835000000001e-11 7.48596e-12 6.24467e-12 ] [ 1.077368e-10 9.216900000000001e-11 1.864842e-10 ] [ 2.976718e-10 2.979813e-10 7.013645e-11 ] [ 1.541867e-10 2.360612e-10 1.695051e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0229553 -3.7574345 -5.2859072 ] [ -12.9278337 -40.3580721 8.7189082 ] [ 10.1013788 4.1212724 -7.0247511 ] [ 3.8494103 39.9942341 3.5917501 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.63895507928646e-09 -6.020073759685473e-09 -8.468957005332364e-09 ] [ -2.071267308237777e-08 -6.466076011190731e-08 1.3969230992031e-08 ] [ 1.618419308454296e-08 6.603006341629101e-09 -1.12548920720858e-08 ] [ 6.16743523733893e-09 6.407782736974601e-08 5.754618085387163e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 6.3119139 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.011280096639981e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.6284372 -0.6293343 -0.086269 ] [ 0.7069248 0.6823178 1.7956017 ] [ 3.343885 3.5873686 0.5929196 ] [ 1.7837895 2.6966225 2.0214518 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.284372e-11 -6.293343e-11 -8.6269e-12 ] [ 7.069248e-11 6.823178e-11 1.7956017e-10 ] [ 3.343885000000001e-10 3.5873686e-10 5.929196e-11 ] [ 1.7837895e-10 2.6966225e-10 2.0214518e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.2e-06 -1.8e-06 3.3e-06 ] [ 6e-06 5e-06 -7.6e-06 ] [ -4.8e-06 -3.6e-06 3.7e-06 ] [ 1.1e-06 4e-07 7e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.5247885948e-15 -2.8839179412e-15 5.2871828922e-15 ] [ 9.613059803999999e-15 8.010883169999999e-15 -1.21765424184e-14 ] [ -7.690447843199998e-15 -5.767835882399999e-15 5.9280535458e-15 ] [ 1.7623942974e-15 6.408706536e-16 1.1215236438e-15 ] ] } "relaxed-potential-energy" { "source-value" -7.9966042 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.281197240058626e-18 } }