{ "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" [ [ 0.1724043 0.1217148 2.355607 ] [ 0.0803944 1.628444 0.6781111 ] [ 0.0194903 2.198586 2.964695 ] [ 2.614645 0.684385 2.185781 ] [ 2.191382 2.601245 1.67848 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.724043e-11 1.217148e-11 2.355607e-10 ] [ 8.03944e-12 1.628444e-10 6.781111e-11 ] [ 1.94903e-12 2.198586e-10 2.964695e-10 ] [ 2.614645e-10 6.84385e-11 2.185781e-10 ] [ 2.191382e-10 2.601245e-10 1.67848e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.3548432 -12.3820964 1.8751864 ] [ -1.5728378 2.0484981 -12.9117819 ] [ -2.3016865 10.8142712 10.798859 ] [ 4.5832687 -16.2438075 4.3442311 ] [ -2.0635877 15.7631345 -4.1064946 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.170698099889859e-09 -1.983830536857185e-08 3.004379809722117e-09 ] [ -2.519963951470507e-09 3.282055763573221e-09 -2.06869550930486e-08 ] [ -3.687708298710979e-09 1.732637248763076e-08 1.730167942111567e-08 ] [ 7.343205957984408e-09 -2.60254486092757e-08 6.960225503772267e-09 ] [ -3.306231967910444e-09 2.52553255664259e-08 -6.579329641561449e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.3334705 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.545161742826487e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.1568786 0.1431696 2.306604 ] [ 0.1846377 1.5168942 0.1095151 ] [ 0.1263322 2.4303478 3.5243811 ] [ 2.7360183 0.393368 2.2837115 ] [ 1.8744491 2.7505951 1.6384624 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.568786e-11 1.431696e-11 2.306604e-10 ] [ 1.846377e-11 1.5168942e-10 1.095151e-11 ] [ 1.263322e-11 2.4303478e-10 3.5243811e-10 ] [ 2.7360183e-10 3.93368e-11 2.2837115e-10 ] [ 1.8744491e-10 2.7505951e-10 1.6384624e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.6e-06 -4.1e-06 5.9e-06 ] [ -3.2e-06 1.07e-05 6.1e-06 ] [ 5e-07 -2.4e-06 -1.57e-05 ] [ 1.15e-05 6.9e-06 5e-07 ] [ -2e-07 -1.11e-05 3.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.377871893888e-14 -6.568924145279999e-15 9.45284206272e-15 ] [ -5.126965186560001e-15 1.714328984256e-14 9.77327738688e-15 ] [ 8.010883104e-16 -3.84522388992e-15 -2.515417294656e-14 ] [ 1.84250311392e-14 1.105501868352e-14 8.010883104e-16 ] [ -3.2043532416e-16 -1.778416049088e-14 5.126965186560001e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.588965 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.177192202386947e-18 } }