{ "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" [ [ 2.581885 1.428418 2.998356 ] [ 2.14644 1.796808 5.429666 ] [ 2.773837 4.089142 2.091611 ] [ 4.654129 1.242937 4.425266 ] [ 3.536635 3.29537 4.044312 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.581885000000001e-10 1.428418e-10 2.998356e-10 ] [ 2.14644e-10 1.796808e-10 5.429666e-10 ] [ 2.773837e-10 4.089142e-10 2.091611e-10 ] [ 4.654129e-10 1.242937e-10 4.425266e-10 ] [ 3.536635e-10 3.29537e-10 4.044312e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.6759346 -4.8700143 -5.4800506 ] [ -4.6443696 -0.7453601 4.928884 ] [ -0.6214233 1.7085206 -2.2707546 ] [ 6.1986495 -3.3785397 0.7816854 ] [ 2.743078 7.2853934 2.0402358 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.8894964757098e-09 -7.802623054421678e-09 -8.780008952121012e-09 ] [ -7.441100391474248e-09 -1.19419852629715e-09 7.896942711435187e-09 ] [ -9.956298828803846e-10 2.737351761475188e-09 -3.638149931694056e-09 ] [ 9.93133130943361e-09 -5.413017319784646e-09 1.252398072700696e-09 ] [ 4.394895440630823e-09 1.167248697881062e-08 3.268818099679185e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -1.7074783 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.735681812783329e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.4673232 1.1125062 2.9337085 ] [ 1.8026638 2.1322428 5.1825019 ] [ 2.7948054 3.572074 2.3156574 ] [ 4.8182854 1.4072864 3.8953661 ] [ 3.8098482 3.6285657 4.6619772 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4673232e-10 1.1125062e-10 2.9337085e-10 ] [ 1.8026638e-10 2.1322428e-10 5.182501900000001e-10 ] [ 2.7948054e-10 3.572074000000001e-10 2.3156574e-10 ] [ 4.8182854e-10 1.4072864e-10 3.8953661e-10 ] [ 3.8098482e-10 3.6285657e-10 4.6619772e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.3e-06 -4.2e-06 -2.9e-06 ] [ -3e-07 2.4e-06 2.7e-06 ] [ 1.6e-06 3.4e-06 1.9e-06 ] [ 3.7e-06 2.9e-06 2.2e-06 ] [ -1.8e-06 -4.4e-06 -3.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.28718284864e-15 -6.72914180736e-15 -4.646312200320001e-15 ] [ -4.8065298624e-16 3.84522388992e-15 4.32587687616e-15 ] [ 2.56348259328e-15 5.44740051072e-15 3.04413557952e-15 ] [ 5.928053496960001e-15 4.646312200320001e-15 3.52478856576e-15 ] [ -2.88391791744e-15 -7.04957713152e-15 -6.08827115904e-15 ] ] } "relaxed-potential-energy" { "source-value" -6.4498528 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.033380336376142e-18 } }