{ "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" [ [ 2.872342 2.592209 3.748836 ] [ 1.410068 4.838391 2.869154 ] [ 2.889421 3.430048 1.520903 ] [ 4.604684 2.417867 2.466033 ] [ 4.898299 2.012755 4.844446 ] [ 5.379024 4.52793 1.309626 ] [ 5.720081 4.239448 3.464417 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.872342e-10 2.592209e-10 3.748836e-10 ] [ 1.410068e-10 4.838391e-10 2.869154e-10 ] [ 2.889421e-10 3.430048e-10 1.520903e-10 ] [ 4.604684e-10 2.417867e-10 2.466033e-10 ] [ 4.898299e-10 2.012755e-10 4.844446e-10 ] [ 5.379024e-10 4.52793e-10 1.309626e-10 ] [ 5.720081000000001e-10 4.239448000000001e-10 3.464417e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.6064351 2.136739 3.6397612 ] [ 1.6930168 -2.6498584 0.7179381 ] [ -2.2995007 3.6474893 -3.6915376 ] [ 6.5245728 -4.7828945 -3.1159976 ] [ 1.779168 1.2046028 1.032782 ] [ -1.6622823 0.8137545 -3.5305664 ] [ 1.5714605 -0.3698328 4.9476202 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.218685258525745e-08 3.423433298756525e-09 5.8315403479798e-09 ] [ 2.712511957929451e-09 -4.245541211888625e-09 1.150263648478355e-09 ] [ -3.684206291406643e-09 5.843922129225016e-09 -5.914495286252438e-09 ] [ 1.045351808699195e-08 -7.663041810787112e-09 -4.992378546320078e-09 ] [ 2.850541397560512e-09 1.929986459410975e-09 1.654699188415788e-09 ] [ -2.663269860171778e-09 1.303778445712353e-09 -5.656590990865498e-09 ] [ 2.517757294353957e-09 -5.925374706467952e-10 7.926961478346406e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.514586 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.005057727338352e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5182811 2.4627914 4.1833112 ] [ 1.4580024 4.1005696 2.8694977 ] [ 2.9829819 4.1286969 1.0788951 ] [ 4.1603649 2.1351815 2.2193329 ] [ 4.9740037 2.5993966 4.6242071 ] [ 5.4387006 4.2653213 1.5198078 ] [ 6.2415845 4.3666907 3.7283632 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5182811e-10 2.4627914e-10 4.183311200000001e-10 ] [ 1.4580024e-10 4.1005696e-10 2.8694977e-10 ] [ 2.9829819e-10 4.1286969e-10 1.0788951e-10 ] [ 4.1603649e-10 2.1351815e-10 2.2193329e-10 ] [ 4.974003700000001e-10 2.5993966e-10 4.624207099999999e-10 ] [ 5.4387006e-10 4.2653213e-10 1.5198078e-10 ] [ 6.241584500000001e-10 4.3666907e-10 3.7283632e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.2e-06 -6e-07 -9e-06 ] [ -1.32e-05 -4.8e-06 4.9e-06 ] [ 4e-06 1.19e-05 -8e-06 ] [ 3.3e-06 2e-07 -5e-07 ] [ 7.5e-06 1.71e-05 1.06e-05 ] [ -8.1e-06 -5.8e-06 5e-07 ] [ -7e-07 -1.79e-05 1.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.15356717648e-14 -9.613059803999998e-16 -1.4419589706e-14 ] [ -2.11487315688e-14 -7.690447843199998e-15 7.850665506599998e-15 ] [ 6.408706535999999e-15 1.90659019446e-14 -1.2817413072e-14 ] [ 5.2871828922e-15 3.204353268e-16 -8.010883169999999e-16 ] [ 1.2016324755e-14 2.73972204414e-14 1.69830723204e-14 ] [ -1.29776307354e-14 -9.2926244772e-15 8.010883169999999e-16 ] [ -1.1215236438e-15 -2.86789617486e-14 2.7237002778e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.711567 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.837705879892547e-18 } }