{ "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" [ [ 1.715482 1.558119 0.3191032 ] [ 2.111919 2.384646 2.793656 ] [ 0.6473775 3.949576 0.9928713 ] [ 3.842985 1.188798 1.171985 ] [ 3.145034 3.056438 0.3971002 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.715482e-10 1.558119e-10 3.191032e-11 ] [ 2.111919e-10 2.384646e-10 2.793656e-10 ] [ 6.473775000000001e-11 3.949576e-10 9.928713000000001e-11 ] [ 3.842985e-10 1.188798e-10 1.171985e-10 ] [ 3.145034e-10 3.056438e-10 3.971002e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -16.8455773 -13.5911162 -13.5400478 ] [ -5.2286519 1.5863881 22.79225 ] [ -7.5172192 6.9955986 0.4517297 ] [ 16.5192537 -13.0825826 3.4733148 ] [ 13.0721948 18.091712 -13.1772466 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.698959011393919e-08 -2.177536862621614e-08 -2.169354802967448e-08 ] [ -8.3772238324815e-09 2.541673925335333e-09 3.65172100854288e-08 ] [ -1.204391285566888e-08 1.120818452542121e-08 7.237507642609978e-10 ] [ 2.64667620712039e-08 -2.096060798140488e-08 5.564863769238627e-09 ] [ 2.094396489110333e-08 2.898611799664681e-08 -2.111227642903629e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 7.8284851 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.254261580350115e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2210196 1.1500285 0.0778032 ] [ 2.1315533 2.460044 3.1023669 ] [ 1.0574463 3.5626795 1.0150961 ] [ 3.5276665 1.2923439 1.2547862 ] [ 3.5251117 3.6724811 0.2246632 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2210196e-10 1.1500285e-10 7.78032e-12 ] [ 2.1315533e-10 2.460044e-10 3.1023669e-10 ] [ 1.0574463e-10 3.5626795e-10 1.0150961e-10 ] [ 3.5276665e-10 1.2923439e-10 1.2547862e-10 ] [ 3.5251117e-10 3.6724811e-10 2.246632e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.52e-05 -1.87e-05 -5.9e-06 ] [ 3.9e-06 -0.0 -4.34e-05 ] [ 2.2e-06 2.9e-05 1.3e-05 ] [ 2.6e-05 5.6e-06 1.46e-05 ] [ -1.68e-05 -1.59e-05 2.17e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.435308463616e-14 -2.996070280896e-14 -9.45284206272e-15 ] [ 6.24848882112e-15 0.0 -6.953446534272e-14 ] [ 3.52478856576e-15 4.64631220032e-14 2.08282960704e-14 ] [ 4.16565921408e-14 8.972189076479999e-15 2.339177866368e-14 ] [ -2.691656722944e-14 -2.547460827072e-14 3.476723267136e-14 ] ] } "relaxed-potential-energy" { "source-value" -9.5001568 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.522092911889414e-18 } }