{ "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" [ [ 2.649462 0.9916265 2.612716 ] [ 1.648491 2.667782 3.780456 ] [ 2.525478 3.798893 2.25676 ] [ 4.349928 2.588165 2.084291 ] [ 3.878534 1.770814 4.034173 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.649462e-10 9.916265e-11 2.612716e-10 ] [ 1.648491e-10 2.667782e-10 3.780456e-10 ] [ 2.525478e-10 3.798893e-10 2.25676e-10 ] [ 4.349928e-10 2.588165e-10 2.084291e-10 ] [ 3.878534e-10 1.770814e-10 4.034173e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.4850431 -6.1178453 -6.2510972 ] [ -3.2220301 -1.2042744 4.776415 ] [ -1.1502413 6.8123542 -5.0736348 ] [ 3.5996943 0.480926 -3.5598572 ] [ 5.2576202 0.0288396 10.1081742 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.185831257302925e-09 -9.80186879008672e-09 -1.001536187070282e-08 ] [ -5.162261340264683e-09 -1.92946030460437e-09 7.652660507287109e-09 ] [ -1.842889734321784e-09 1.091459472177176e-08 -8.128859126009261e-09 ] [ 5.767346097002985e-09 7.705283998830839e-10 -5.703520026216664e-09 ] [ 8.423636234886407e-09 4.620613325390639e-11 1.619508051564164e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -11.240461 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.800920396958827e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6708602 0.7119167 2.5366723 ] [ 1.7096096 2.6101847 3.7364159 ] [ 2.5348771 4.1790316 2.1974139 ] [ 4.2009329 2.5375621 1.995651 ] [ 3.9356132 1.7785854 4.302243 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6708602e-10 7.119167e-11 2.5366723e-10 ] [ 1.7096096e-10 2.6101847e-10 3.7364159e-10 ] [ 2.5348771e-10 4.1790316e-10 2.1974139e-10 ] [ 4.2009329e-10 2.5375621e-10 1.995651e-10 ] [ 3.9356132e-10 1.7785854e-10 4.302243e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.26e-05 1.35e-05 3.31e-05 ] [ -1e-06 -1.26e-05 6.2e-06 ] [ -7.5e-06 3.11e-05 -8.4e-06 ] [ 9.2e-06 -1.28e-05 -2.7e-06 ] [ -2.32e-05 -1.91e-05 -2.82e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.62091919284e-14 2.162938455899999e-14 5.303204658539999e-14 ] [ -1.602176634e-15 -2.01874255884e-14 9.9334951308e-15 ] [ -1.2016324755e-14 4.982769331739999e-14 -1.34582837256e-14 ] [ 1.47400250328e-14 -2.05078609152e-14 -4.3258769118e-15 ] [ -3.71704979088e-14 -3.06015737094e-14 -4.51813810788e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.226263 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.279298616773874e-18 } }