{ "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" [ [ 2.10043 2.130682 2.453785 ] [ 1.948071 1.785129 4.606922 ] [ 2.343053 4.336787 1.957735 ] [ 4.413531 1.079857 2.965455 ] [ 3.524463 3.435576 3.796327 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.10043e-10 2.130682e-10 2.453785e-10 ] [ 1.948071e-10 1.785129e-10 4.606922e-10 ] [ 2.343053e-10 4.336787e-10 1.957735e-10 ] [ 4.413531e-10 1.079857e-10 2.965455e-10 ] [ 3.524463e-10 3.435576e-10 3.796327e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2024399 -2.7604523 -3.5848543 ] [ -0.5354389 -0.096611 3.1216271 ] [ 0.1147418 1.4918168 -0.3957266 ] [ -1.0374635 1.5459226 -0.1830706 ] [ 1.6606004 -0.1806761 1.0420243 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.2434447489709e-10 -4.422732137893588e-09 -5.74356974843435e-09 ] [ -8.578676874468693e-10 -1.547878855121088e-10 5.001397958475704e-09 ] [ 1.838366293885095e-10 2.390153999476669e-09 -6.340239067486733e-10 ] [ -1.662199764633341e-09 2.47684104728635e-09 -2.933114352758285e-10 ] [ 2.660575137371128e-09 -2.894750233573229e-10 1.669506971765485e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.116568 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.941288197393341e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1328982 1.8640625 2.399106 ] [ 1.6852837 2.0489339 4.7590644 ] [ 2.4333456 4.228618 2.0490691 ] [ 4.4791107 1.3832703 2.6599861 ] [ 3.5989098 3.2431463 3.9129984 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1328982e-10 1.8640625e-10 2.399106e-10 ] [ 1.6852837e-10 2.0489339e-10 4.7590644e-10 ] [ 2.4333456e-10 4.228618e-10 2.0490691e-10 ] [ 4.4791107e-10 1.3832703e-10 2.6599861e-10 ] [ 3.5989098e-10 3.2431463e-10 3.9129984e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.9e-06 -2.67e-05 -7.5e-06 ] [ 5.1e-06 8e-07 -1.14e-05 ] [ -3.55e-05 5.81e-05 -4.5e-06 ] [ 1.35e-05 -3.83e-05 2.08e-05 ] [ 1.87e-05 6.1e-06 2.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.04413557952e-15 -4.277811577536e-14 -1.2016324656e-14 ] [ 8.17110076608e-15 1.28174129664e-15 -1.826481347712e-14 ] [ -5.68772700384e-14 9.308646166848001e-14 -7.2097947936e-15 ] [ 2.16293843808e-14 -6.136336457664001e-14 3.332527371264e-14 ] [ 2.996070280896e-14 9.77327738688e-15 4.16565921408e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.21532 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.117327674039066e-18 } }