{ "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" [ [ 0.5633223 0.534565 2.657113 ] [ 0.571871 1.718695 0.3060373 ] [ 0.67165 2.82724 1.843012 ] [ 2.670346 0.5025148 0.7068498 ] [ 2.297338 0.3834159 2.609917 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.633223000000001e-11 5.34565e-11 2.657113e-10 ] [ 5.71871e-11 1.718695e-10 3.060373e-11 ] [ 6.7165e-11 2.82724e-10 1.843012e-10 ] [ 2.670346e-10 5.025148000000001e-11 7.068498e-11 ] [ 2.297338e-10 3.834159e-11 2.609917e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -343.2123165 206.0018872 -14.3663014 ] [ 70.8380423 -195.1323945 -262.5450685 ] [ -18.3040655 4.8442796 296.7238195 ] [ -61.5086559 51.0607855 -117.5628471 ] [ 352.1869956 -66.7745578 97.7503975 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.498867494669101e-07 3.300514075125188e-07 -2.301735223044631e-08 ] [ 1.134950552363015e-07 -3.126365604286225e-07 -4.206435706570345e-07 ] [ -2.932634580969187e-08 7.761391519738377e-09 4.754039664373791e-07 ] [ -9.854773045981198e-08 8.180839676778364e-08 -1.883564450983051e-07 ] [ 5.642657705001125e-07 -1.069846353714183e-07 1.566134015484068e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 158.3425 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.53692651579024e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.4137384 0.9814628 3.8125986 ] [ 1.0186802 2.1958478 -0.5217861 ] [ -0.354099 2.8501489 1.8495728 ] [ 3.0072914 0.3107039 0.1337606 ] [ 2.6889163 -0.3717326 2.8487832 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.137384e-11 9.814628e-11 3.8125986e-10 ] [ 1.0186802e-10 2.1958478e-10 -5.217861000000001e-11 ] [ -3.54099e-11 2.850148900000001e-10 1.8495728e-10 ] [ 3.007291400000001e-10 3.107039e-11 1.337606e-11 ] [ 2.6889163e-10 -3.717326e-11 2.8487832e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.2e-06 -1e-07 -1.04e-05 ] [ -2.7e-06 -4.8e-06 7.6e-06 ] [ -1e-06 7.1e-06 1.1e-06 ] [ -2e-07 -4e-07 2.1e-06 ] [ 6.1e-06 -1.7e-06 -3e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.52478856576e-15 -1.6021766208e-16 -1.666263685632e-14 ] [ -4.32587687616e-15 -7.69044777984e-15 1.217654231808e-14 ] [ -1.6021766208e-15 1.137545400768e-14 1.76239428288e-15 ] [ -3.2043532416e-16 -6.408706483200001e-16 3.36457090368e-15 ] [ 9.77327738688e-15 -2.72370025536e-15 -4.8065298624e-16 ] ] } "relaxed-potential-energy" { "source-value" -12.190057 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.953062433161938e-18 } }