{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.1566283 0.5933374 0.8739195 ] [ 1.297564 0.9258578 2.544594 ] [ 0.4571517 2.983075 2.098516 ] [ 2.386894 1.49419 0.7409216 ] [ 2.718839 0.4423949 1.931638 ] [ 1.685227 2.953094 0.1464224 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.566283e-11 5.933374e-11 8.739195e-11 ] [ 1.297564e-10 9.258578e-11 2.544594e-10 ] [ 4.571517e-11 2.983075e-10 2.098516e-10 ] [ 2.386894e-10 1.49419e-10 7.409215999999999e-11 ] [ 2.718839e-10 4.423949e-11 1.931638e-10 ] [ 1.685227e-10 2.953094e-10 1.464224e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.2811534 0.5573025 -4.2532942 ] [ -38.2342062 13.8114955 24.6340433 ] [ 0.1337711 -1.0515897 -0.4000422 ] [ 6.3522772 3.9242862 -24.9037891 ] [ 46.3820885 -39.3387094 13.0792578 ] [ -12.3527772 22.097215 -8.1561756 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.654810645938431e-09 8.92897036213392e-10 -6.814528528624239e-09 ] [ -6.125795128848641e-08 2.212845518838441e-08 3.946808825103488e-08 ] [ 2.143249289586989e-10 -1.684832432014086e-09 -6.409382601733977e-10 ] [ 1.017747001868089e-08 6.287399602968073e-09 -3.990026866535388e-08 ] [ 7.431229781857655e-08 -6.30275604931252e-08 2.095528106457605e-08 ] [ -1.979133083179129e-08 3.540364125779107e-08 -1.306763386145941e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 3.0885664 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.948428877868421e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.0877869 1.3340736 0.5964706 ] [ 0.8230813 0.3953559 2.6212861 ] [ 0.7710023 2.6965114 2.4383466 ] [ 2.2598693 0.5908627 0.0950433 ] [ 2.8363298 1.5217121 2.1742098 ] [ 1.9242344 2.8534334 0.4106551 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.778690000000001e-12 1.3340736e-10 5.964706e-11 ] [ 8.230813e-11 3.953559e-11 2.6212861e-10 ] [ 7.710023e-11 2.6965114e-10 2.4383466e-10 ] [ 2.2598693e-10 5.908627e-11 9.50433e-12 ] [ 2.8363298e-10 1.5217121e-10 2.1742098e-10 ] [ 1.9242344e-10 2.8534334e-10 4.106551e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.33e-05 2.63e-05 2.53e-05 ] [ 2.76e-05 3.02e-05 -5.61e-05 ] [ -3.94e-05 -3.76e-05 9e-06 ] [ -5.09e-05 -1.2e-06 4.39e-05 ] [ -9e-07 1.33e-05 -1.55e-05 ] [ 1.02e-05 -3.1e-05 -6.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.539601388864e-14 4.213724512704e-14 4.053506850624e-14 ] [ 4.422007473408001e-14 4.838573394816e-14 -8.988210842688002e-14 ] [ -6.312575885952001e-14 -6.024184094208e-14 1.44195895872e-14 ] [ -8.155078999872e-14 -1.92261194496e-15 7.033555365312e-14 ] [ -1.44195895872e-15 2.130894905664e-14 -2.48337376224e-14 ] [ 1.634220153216e-14 -4.96674752448e-14 -1.057436569728e-14 ] ] } "relaxed-potential-energy" { "source-value" -26.223076 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.201399929266158e-18 } }