{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.246807 1.041122 2.124463 ] [ 1.267764 1.326115 3.99765 ] [ 2.011294 2.700157 5.439591 ] [ 2.31677 3.176049 2.822929 ] [ 4.533635 0.1687206 2.857812 ] [ 4.258439 2.493804 2.204153 ] [ 4.092776 1.731475 4.602458 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.246807e-10 1.041122e-10 2.124463e-10 ] [ 1.267764e-10 1.326115e-10 3.99765e-10 ] [ 2.011294e-10 2.700157e-10 5.439591000000001e-10 ] [ 2.31677e-10 3.176049e-10 2.822929e-10 ] [ 4.533635000000001e-10 1.687206e-11 2.857812e-10 ] [ 4.258439e-10 2.493804e-10 2.204153e-10 ] [ 4.092776e-10 1.731475e-10 4.602458e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.7729309 -7.0411825 -7.0366829 ] [ -7.6204042 -5.2746703 2.5832674 ] [ 0.3570686 2.0463462 4.2431981 ] [ -3.2956201 10.5274923 -3.6849618 ] [ 1.3598113 -3.8059475 -0.3230966 ] [ 6.2901709 4.130708 -3.610088 ] [ 6.6819043 -0.5827462 7.8283639 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.044901679873903e-09 -1.12812179842861e-08 -1.127400883036314e-08 ] [ -1.220923345028613e-08 -8.450953437088122e-09 4.138850633554802e-09 ] [ 5.720869629417869e-10 3.278608039702921e-09 6.798352793242981e-09 ] [ -5.280165475258558e-09 1.686690203871202e-08 -5.903959644501085e-09 ] [ 2.178657873559655e-09 -6.097800104492208e-09 -5.176578187799693e-10 ] [ 1.007796475681649e-08 6.618123784951527e-09 -5.783998592630631e-09 ] [ 1.070559085188299e-08 -9.33662337500041e-10 1.254242161969471e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -3.802547 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.092351902893179e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.9956647 0.8485945 2.2086862 ] [ 0.894874 0.8581898 4.3324612 ] [ 2.2476508 2.7378076 4.9324314 ] [ 2.3951269 3.3205273 2.5773353 ] [ 4.3338136 0.632451 2.836474 ] [ 4.6927753 2.8744977 2.0832802 ] [ 4.1675798 1.3653747 5.0783878 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9956647e-10 8.485945000000001e-11 2.2086862e-10 ] [ 8.94874e-11 8.581898e-11 4.3324612e-10 ] [ 2.2476508e-10 2.7378076e-10 4.9324314e-10 ] [ 2.3951269e-10 3.3205273e-10 2.5773353e-10 ] [ 4.3338136e-10 6.32451e-11 2.836474e-10 ] [ 4.6927753e-10 2.8744977e-10 2.0832802e-10 ] [ 4.167579800000001e-10 1.3653747e-10 5.0783878e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.7e-06 7.4e-06 8.3e-06 ] [ 2.56e-05 -9.1e-06 -3.8e-06 ] [ -2.22e-05 1.3e-06 -3.5e-06 ] [ 1.21e-05 1.11e-05 1.35e-05 ] [ 2.9e-06 -1.27e-05 -1.62e-05 ] [ 6e-07 -1.09e-05 -8.1e-06 ] [ -1.04e-05 1.29e-05 9.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.393893660096e-14 1.185610699392e-14 1.329806595264e-14 ] [ 4.101572149248001e-14 -1.457980724928e-14 -6.08827115904e-15 ] [ -3.556832098176e-14 2.08282960704e-15 -5.6076181728e-15 ] [ 1.938633711168e-14 1.778416049088e-14 2.16293843808e-14 ] [ 4.646312200320001e-15 -2.034764308416e-14 -2.595526125696e-14 ] [ 9.6130597248e-16 -1.746372516672e-14 -1.297763062848e-14 ] [ -1.666263685632e-14 2.066807840832e-14 1.554111322176e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.906007 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.907552606248115e-18 } }