{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.767239e-10 -9.905389e-11 2.1856194e-10 ] [ 2.0861582e-10 2.9781961e-10 -1.8688981e-10 ] [ -1.4910636e-10 2.699426e-10 2.2995226e-10 ] [ 1.1142936e-10 1.9280279e-10 7.081469300000001e-10 ] [ 2.5870959e-10 6.2407745e-10 3.8785395e-10 ] [ 6.6919891e-10 3.8721456e-10 1.0011439e-10 ] [ 6.4132406e-10 1.2001018e-10 5.8003569e-10 ] ] "source-value" [ [ 2.767239 -0.9905389 2.1856194 ] [ 2.0861582 2.9781961 -1.8688981 ] [ -1.4910636 2.699426 2.2995226 ] [ 1.1142936 1.9280279 7.0814693 ] [ 2.5870959 6.2407745 3.8785395 ] [ 6.6919891 3.8721456 1.0011439 ] [ 6.4132406 1.2001018 5.8003569 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 -6.408706483200001e-16 ] [ -6.408706483200001e-16 0.0 -1.6021766208e-16 ] [ -1.6021766208e-16 0.0 6.408706483200001e-16 ] [ 0.0 0.0 0.0 ] [ 4.8065298624e-16 3.2043532416e-16 -1.6021766208e-16 ] [ 4.8065298624e-16 -3.2043532416e-16 3.2043532416e-16 ] ] "source-value" [ [ 0.0 0.0 0.0 ] [ -0.0 -0.0 -4e-07 ] [ -4e-07 0.0 -1e-07 ] [ -1e-07 -0.0 4e-07 ] [ 0.0 0.0 0.0 ] [ 3e-07 2e-07 -1e-07 ] [ 3e-07 -2e-07 2e-07 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 4.555438665000169e-31 "source-value" 2.8432812e-12 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -4.118867645869536e-10 -5.966443090753326e-09 -1.823617777437644e-09 ] [ -5.685684228648481e-10 4.036687200458842e-10 -4.464010776569541e-09 ] [ -5.802952181837032e-09 5.144156541701184e-11 -1.381318816669989e-09 ] [ -2.853955612454419e-09 -1.050470786433748e-09 6.122170332418211e-09 ] [ -2.023387252231699e-10 6.514766409837747e-09 8.959044819482957e-10 ] [ 4.641856066484569e-09 1.861856926846278e-09 -2.863186072402172e-09 ] [ 5.197845480264193e-09 -1.814819744959845e-09 3.514058468495178e-09 ] ] "source-value" [ [ -0.2570795 -3.7239609 -1.1382127 ] [ -0.3548725 0.2519502 -2.7862164 ] [ -3.6219179 0.0321073 -0.8621514 ] [ -1.781299 -0.6556523 3.8211582 ] [ -0.1262899 4.0661974 0.5591796 ] [ 2.8972187 1.1620797 -1.7870602 ] [ 3.24424 -1.1327214 2.1933028 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 2.737989107334943e-18 "source-value" 17.089184 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.872972e-10 1.012553e-10 2.780557e-10 ] [ 2.489863e-10 2.81954e-10 4.602746e-11 ] [ 1.064652e-10 2.650766e-10 2.601591e-10 ] [ 2.280466e-10 2.401905e-10 4.700098e-10 ] [ 2.677321e-10 4.010574e-10 3.508674e-10 ] [ 4.446125000000001e-10 3.093023e-10 2.174548e-10 ] [ 4.337554e-10 1.939772e-10 4.152011e-10 ] ] "source-value" [ [ 2.872972 1.012553 2.780557 ] [ 2.489863 2.81954 0.4602746 ] [ 1.064652 2.650766 2.601591 ] [ 2.280466 2.401905 4.700098 ] [ 2.677321 4.010574 3.508674 ] [ 4.446125 3.093023 2.174548 ] [ 4.337554 1.939772 4.152011 ] ] } "instance-id" 1 }