{ "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" [ [ 2.146488 0.2959799 2.352543 ] [ 2.393537 2.53814 1.109639 ] [ 1.99319 1.640865 4.12466 ] [ 3.097066 3.51077 3.500726 ] [ 3.970578 1.750203 2.795194 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.146488e-10 2.959799e-11 2.352543e-10 ] [ 2.393537e-10 2.53814e-10 1.109639e-10 ] [ 1.99319e-10 1.640865e-10 4.12466e-10 ] [ 3.097066e-10 3.51077e-10 3.500726e-10 ] [ 3.970578e-10 1.750203e-10 2.795194e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4151839 0.7636345 -1.6698773 ] [ 1.247527 -0.6606719 4.1469822 ] [ -0.1148523 -0.1034469 0.8222333 ] [ -2.3422419 4.1046221 -1.1769192 ] [ 0.7943833 -4.1041378 -2.122419 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.651979379125651e-10 1.223477342736298e-09 -2.675438369664628e-09 ] [ 1.998758593216762e-09 -1.058513072199516e-09 6.644197927713749e-09 ] [ -1.840136699051078e-10 -1.657402046742355e-10 1.317362970103233e-09 ] [ -3.752685212438171e-09 6.576329565839e-09 -1.885632426810639e-09 ] [ 1.272742351213953e-09 -6.575553631701547e-09 -3.400490101341715e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.821137 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.015478567827385e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0792081 0.374738 2.2027305 ] [ 2.4797836 2.499729 1.360177 ] [ 2.1244283 1.6234514 4.1583938 ] [ 2.9257213 3.638791 3.3323905 ] [ 3.9917177 1.5992485 2.8290702 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0792081e-10 3.74738e-11 2.2027305e-10 ] [ 2.4797836e-10 2.499729e-10 1.360177e-10 ] [ 2.1244283e-10 1.6234514e-10 4.1583938e-10 ] [ 2.9257213e-10 3.638791e-10 3.3323905e-10 ] [ 3.9917177e-10 1.5992485e-10 2.8290702e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.18e-05 -2e-07 8.2e-06 ] [ 1.61e-05 3.25e-05 -7.12e-05 ] [ -7.1e-06 -3e-05 7e-05 ] [ -1.78e-05 1.4e-05 -3.9e-06 ] [ 2.06e-05 -1.63e-05 -3.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.890568412544e-14 -3.2043532416e-16 1.313784829056e-14 ] [ 2.579504359488e-14 5.207074017599999e-14 -1.1407497540096e-13 ] [ -1.137545400768e-14 -4.8065298624e-14 1.12152363456e-13 ] [ -2.851874385024e-14 2.24304726912e-14 -6.24848882112e-15 ] [ 3.300483838848e-14 -2.611547891904e-14 -4.96674752448e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.467452 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.279247308174621e-18 } }