{ "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" [ [ 2.91343 2.805447 1.311156 ] [ 2.653002 2.505168 3.277079 ] [ 1.829519 4.618852 2.376516 ] [ 4.982305 1.900488 2.423676 ] [ 4.143762 3.996307 2.985709 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.91343e-10 2.805447e-10 1.311156e-10 ] [ 2.653002e-10 2.505168e-10 3.277079e-10 ] [ 1.829519e-10 4.618852000000001e-10 2.376516e-10 ] [ 4.982305e-10 1.900488e-10 2.423676e-10 ] [ 4.143762e-10 3.996307e-10 2.985709e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.2421474 -0.3637648 -4.2821791 ] [ -1.9840264 -2.314829 3.8597513 ] [ -0.3492858 0.5059641 0.0477656 ] [ -0.0050099 -0.3152291 -0.2050868 ] [ 2.0961747 2.4878588 0.5797489 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.879629062638516e-10 -5.828154628316832e-10 -6.860807296623148e-09 ] [ -3.178760739319138e-09 -3.708764935505586e-09 6.184003345911123e-09 ] [ -5.596175473479971e-10 8.106438586628394e-10 7.65289282289904e-11 ] [ -8.0267447186766e-12 -5.050526983768494e-10 -3.285852789018312e-10 ] [ 3.35844212512196e-09 3.985989238051279e-09 9.288601411672025e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -8.874501432689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.421851883385492e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.0174188 2.8438271 0.7447421 ] [ 2.4387126 2.2185094 3.7130213 ] [ 2.1355646 4.2291051 2.4710637 ] [ 4.4732427 2.1013997 2.478591 ] [ 4.4570794 4.4334207 2.966718 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0174188e-10 2.8438271e-10 7.447421e-11 ] [ 2.4387126e-10 2.2185094e-10 3.7130213e-10 ] [ 2.1355646e-10 4.2291051e-10 2.471063700000001e-10 ] [ 4.4732427e-10 2.1013997e-10 2.478591e-10 ] [ 4.4570794e-10 4.4334207e-10 2.966718e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.5e-06 6e-07 1.6e-05 ] [ 5e-07 1.06e-05 -7.3e-06 ] [ 9.1e-06 -1.16e-05 3.5e-06 ] [ -8.5e-06 1.3e-05 -6.9e-06 ] [ -8.6e-06 -1.26e-05 -5.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.2016324755e-14 9.613059803999998e-16 2.5634826144e-14 ] [ 8.010883169999999e-16 1.69830723204e-14 -1.16958894282e-14 ] [ 1.45798073694e-14 -1.85852489544e-14 5.607618218999999e-15 ] [ -1.3618501389e-14 2.082829624199999e-14 -1.10550187746e-14 ] [ -1.37787190524e-14 -2.01874255884e-14 -8.6517538236e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.674324432689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.03065064577907e-18 } }