{ "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" ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.0660772 -0.2402167 -1.9981021 ] [ -0.83157 -0.2519758 0.3171695 ] [ -0.2770506 1.027743 1.0960162 ] [ -0.808051 -0.2488707 -0.9419131 ] [ 1.1364357 0.6083571 1.7219695 ] [ 0.8463131 -0.8950369 -0.1951401 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.058673450079258e-10 -3.848695806657274e-10 -3.201312470591384e-09 ] [ -1.332322012558656e-09 -4.037097357673767e-10 5.081615577308256e-10 ] [ -4.438839940986125e-10 1.646625806790854e-09 1.756011531658057e-09 ] [ -1.294640420614061e-09 -3.987348171421305e-10 -1.509111147645252e-09 ] [ 1.820770709582483e-09 9.746955227176877e-10 2.758899274630666e-09 ] [ 1.355943062696773e-09 -1.434007195933308e-09 -3.126489060005741e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -5.990612279081937 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.598018937822485e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.1727375 1.7034248 1.3463012 ] [ 2.6316625 3.9823504 1.5139409 ] [ 4.2852165 1.3587339 0.2417743 ] [ 5.3989461 2.1885844 2.1134624 ] [ 3.286456 2.5332822 3.2179679 ] [ 4.7441634 3.6376514 0.4094564 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1727375e-10 1.7034248e-10 1.3463012e-10 ] [ 2.6316625e-10 3.9823504e-10 1.5139409e-10 ] [ 4.2852165e-10 1.3587339e-10 2.417743e-11 ] [ 5.3989461e-10 2.1885844e-10 2.1134624e-10 ] [ 3.286456e-10 2.5332822e-10 3.2179679e-10 ] [ 4.7441634e-10 3.6376514e-10 4.094564e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.71e-05 -4e-06 4e-07 ] [ 1.39e-05 -1.11e-05 -2.2e-06 ] [ -3.3e-06 6.4e-06 7.9e-06 ] [ -1.6e-06 9.9e-06 -6e-07 ] [ 1.2e-06 -6.4e-06 -6e-07 ] [ 6.9e-06 5.1e-06 -4.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.739722021568e-14 -6.4087064832e-15 6.408706483200001e-16 ] [ 2.227025502912e-14 -1.778416049088e-14 -3.52478856576e-15 ] [ -5.28718284864e-15 1.025393037312e-14 1.265719530432e-14 ] [ -2.56348259328e-15 1.586154854592e-14 -9.6130597248e-16 ] [ 1.92261194496e-15 -1.025393037312e-14 -9.6130597248e-16 ] [ 1.105501868352e-14 8.17110076608e-15 -7.850665441919999e-15 ] ] } "relaxed-potential-energy" { "source-value" -6.635338279081939 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.063098386184439e-18 } }