{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.327038 2.33879 1.333944 ] [ 3.095823 1.457233 3.921802 ] [ 1.16952 4.791902 2.053879 ] [ 1.997895 3.950607 4.032131 ] [ 4.742513 1.791132 2.167365 ] [ 3.563011 4.139404 2.001972 ] [ 4.473125 3.165685 4.251983 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.327038e-10 2.33879e-10 1.333944e-10 ] [ 3.095823e-10 1.457233e-10 3.921802e-10 ] [ 1.16952e-10 4.791902e-10 2.053879e-10 ] [ 1.997895e-10 3.950607e-10 4.032131e-10 ] [ 4.742513e-10 1.791132e-10 2.167365e-10 ] [ 3.563011e-10 4.139404e-10 2.001972e-10 ] [ 4.473124999999999e-10 3.165685e-10 4.251983e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1836821 -1.7091552 -1.2321788 ] [ -2.5412587 -2.4771171 0.815822 ] [ -1.6395321 0.7928199 -0.690165 ] [ -1.7829473 0.2836801 2.9899182 ] [ 2.386722 -2.3042073 -2.3795137 ] [ 2.4735182 3.0272533 -2.1855411 ] [ 2.2871801 2.3867263 2.6816583 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.896467787079447e-09 -2.738368502758749e-09 -1.974168066005399e-09 ] [ -4.071545276544601e-09 -3.968779104603896e-09 1.307090935134298e-09 ] [ -2.626819999671128e-09 1.270237508284994e-09 -1.105766227494432e-09 ] [ -2.856596480178484e-09 4.54505624006206e-10 4.790377038144419e-09 ] [ 3.823950188749018e-09 -3.691747065536692e-09 -3.812401219013305e-09 ] [ 3.963013031163299e-09 4.850194462499649e-09 -3.501622854217515e-09 ] [ 3.664466483779006e-09 3.823957078108487e-09 4.296490233234273e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.9218819 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.589660721451869e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4664749 1.8621494 1.705222 ] [ 1.7631483 1.4091132 3.8483665 ] [ 1.8391886 4.1769992 2.1522441 ] [ 2.2416849 3.5956296 4.3819204 ] [ 4.6441807 2.6473824 2.0405309 ] [ 3.9377528 4.7402747 1.3961189 ] [ 4.4764948 3.2032046 4.2386732 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4664749e-10 1.8621494e-10 1.705222e-10 ] [ 1.7631483e-10 1.4091132e-10 3.8483665e-10 ] [ 1.8391886e-10 4.1769992e-10 2.1522441e-10 ] [ 2.2416849e-10 3.5956296e-10 4.381920400000001e-10 ] [ 4.6441807e-10 2.6473824e-10 2.0405309e-10 ] [ 3.9377528e-10 4.7402747e-10 1.3961189e-10 ] [ 4.476494800000001e-10 3.2032046e-10 4.2386732e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.87e-05 1.13e-05 3.1e-06 ] [ -1.66e-05 1.71e-05 3.7e-06 ] [ -1.98e-05 -1.3e-05 1.44e-05 ] [ 6.8e-06 -2.25e-05 -1.62e-05 ] [ 5.25e-05 -1.47e-05 -1.3e-06 ] [ -6.8e-06 2.65e-05 -3.39e-05 ] [ 2.6e-06 -4.7e-06 3.02e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.996070280896e-14 1.810459581504e-14 4.96674752448e-15 ] [ -2.659613190528e-14 2.739722021568e-14 5.928053496960001e-15 ] [ -3.172309709184e-14 -2.08282960704e-14 2.307134333952e-14 ] [ 1.089480102144e-14 -3.604897396800001e-14 -2.595526125696e-14 ] [ 8.4114272592e-14 -2.355199632576e-14 -2.08282960704e-15 ] [ -1.089480102144e-14 4.24576804512e-14 -5.431378744512e-14 ] [ 4.16565921408e-15 -7.53023011776e-15 4.838573394816e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.23956 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.281429012247885e-18 } }