{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.1881403e-10 1.6625859e-10 1.2999307e-10 ] [ 2.6510367e-10 4.0129522e-10 1.489734e-10 ] [ 4.257395e-10 1.3263861e-10 2.448348e-11 ] [ 5.3937665e-10 2.2091739e-10 2.1687345e-10 ] [ 3.326344e-10 2.510597e-10 3.2393517e-10 ] [ 4.702499399999999e-10 3.682332e-10 4.003175e-11 ] ] "source-value" [ [ 2.1881403 1.6625859 1.2999307 ] [ 2.6510367 4.0129522 1.489734 ] [ 4.257395 1.3263861 0.2448348 ] [ 5.3937665 2.2091739 2.1687345 ] [ 3.326344 2.510597 3.2393517 ] [ 4.7024994 3.682332 0.4003175 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.42978241640192e-12 -8.74852522021632e-12 2.77032359502528e-12 ] [ -6.7099156879104e-12 1.30305024569664e-12 -4.229105408263681e-12 ] [ -1.057949266246656e-11 -3.70439256495168e-12 -7.96714368225216e-12 ] [ -7.945994950857601e-12 -2.40022079562048e-12 1.305677815354752e-11 ] [ 1.285730716425792e-11 2.0740176356256e-12 -2.75382117583104e-12 ] [ 1.094831372057472e-11 1.147607069946624e-11 -8.7703148222592e-13 ] ] "source-value" [ [ 0.0008924 -0.0054604 0.0017291 ] [ -0.004188 0.0008133 -0.0026396 ] [ -0.0066032 -0.0023121 -0.0049727 ] [ -0.0049595 -0.0014981 0.0081494 ] [ 0.0080249 0.0012945 -0.0017188 ] [ 0.0068334 0.0071628 -0.0005474 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.270247401442601e-18 "source-value" -20.411279 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 5.353996818080601e-10 -5.398308216882067e-10 -3.243503869288206e-09 ] [ -6.10779688551769e-10 -5.056331628055412e-10 1.008411567308141e-10 ] [ -1.040302892945165e-09 1.867631491822965e-09 2.113974799024717e-09 ] [ -2.032923567696363e-09 -2.555500549355174e-10 -9.65065159485383e-10 ] [ 2.420047891520542e-09 6.070698485863066e-10 2.148260577621527e-09 ] [ 7.285587360823565e-10 -1.173687300980006e-09 -1.545076648211309e-10 ] ] "source-value" [ [ 0.3341702 -0.3369359 -2.0244359 ] [ -0.3812187 -0.3155914 0.0629401 ] [ -0.649306 1.1656839 1.3194393 ] [ -1.2688511 -0.1595018 -0.6023463 ] [ 1.5104751 0.3789032 1.3408388 ] [ 0.4547306 -0.732558 -0.0964361 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.162849016455838e-18 "source-value" -19.740951 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.336271e-10 1.731327e-10 1.289714e-10 ] [ 2.769645e-10 4.287083e-10 1.737277e-10 ] [ 4.480326e-10 1.077167e-10 1.08092e-11 ] [ 5.392167e-10 2.307543e-10 2.197028e-10 ] [ 3.12468e-10 2.467020000000001e-10 3.187134e-10 ] [ 4.416093e-10 3.533887e-10 3.236582e-11 ] ] "source-value" [ [ 2.336271 1.731327 1.289714 ] [ 2.769645 4.287083 1.737277 ] [ 4.480326 1.077167 0.108092 ] [ 5.392167 2.307543 2.197028 ] [ 3.12468 2.46702 3.187134 ] [ 4.416093 3.533887 0.3236582 ] ] } "instance-id" 1 }