{ "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" [ [ 0.7607129 0.1029019 2.480933 ] [ 0.9158836 2.552597 0.2381701 ] [ 0.8989231 2.268448 2.632769 ] [ 2.109562 0.2713555 0.0459784 ] [ 2.969591 1.985029 0.1686784 ] [ 2.973458 2.362165 2.304699 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.607129000000001e-11 1.029019e-11 2.480933e-10 ] [ 9.158836e-11 2.552597e-10 2.381701e-11 ] [ 8.989231e-11 2.268448e-10 2.632769e-10 ] [ 2.109562e-10 2.713555e-11 4.59784e-12 ] [ 2.969591e-10 1.985029e-10 1.686784e-11 ] [ 2.973458e-10 2.362165e-10 2.304699e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.2790346 -0.5971705 -3.4164073 ] [ -3.045996 -2.7257855 5.7307972 ] [ -8.4331187 2.0829319 -3.3950825 ] [ -31.9568668 -53.9234449 -0.2863922 ] [ 34.2041136 55.7473636 2.1089421 ] [ 6.9528332 -0.5838947 -0.7418573 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.65141595411428e-09 -9.567726137314465e-10 -5.473687903190452e-09 ] [ -4.880223578250317e-09 -4.367189801415639e-09 9.1817492923861e-09 ] [ -1.351134562157129e-08 3.337224792898524e-09 -5.439521807187216e-09 ] [ -5.120054486097971e-08 -8.6394882731777e-08 -4.588508872194777e-10 ] [ 5.480103114510732e-08 8.931712263115692e-08 3.378897727240856e-09 ] [ 1.113966680136205e-08 -9.355024373490297e-10 -1.188586422029812e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.436295 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.114037744397194e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8569285 0.4720632 2.1035066 ] [ 0.988641 2.1059482 0.6124555 ] [ 0.7591075 2.5911352 2.7547985 ] [ 2.2675434 0.3083914 0.4042475 ] [ 3.0853023 2.3212279 -0.0473864 ] [ 2.6706077 1.7437304 2.0436061 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.569285000000001e-11 4.720632000000001e-11 2.1035066e-10 ] [ 9.88641e-11 2.1059482e-10 6.124555000000001e-11 ] [ 7.591075e-11 2.5911352e-10 2.7547985e-10 ] [ 2.2675434e-10 3.083914e-11 4.042475e-11 ] [ 3.0853023e-10 2.3212279e-10 -4.73864e-12 ] [ 2.6706077e-10 1.7437304e-10 2.0436061e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.1e-06 3.62e-05 -1.41e-05 ] [ -3.88e-05 1.58e-05 3.95e-05 ] [ -2.69e-05 8.7e-06 3.4e-06 ] [ 3.1e-05 -8.71e-05 -3.28e-05 ] [ 1.22e-05 2.65e-05 -1.57e-05 ] [ 3.15e-05 -1e-07 1.97e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.457980724928e-14 5.799879367296e-14 -2.259069035328e-14 ] [ -6.216445288704e-14 2.531439060864e-14 6.32859765216e-14 ] [ -4.309855109952001e-14 1.393893660096e-14 5.44740051072e-15 ] [ 4.96674752448e-14 -1.3954958367168e-13 -5.255139316223999e-14 ] [ 1.954655477376e-14 4.24576804512e-14 -2.515417294656e-14 ] [ 5.04685635552e-14 -1.6021766208e-16 3.156287942976e-14 ] ] } "relaxed-potential-energy" { "source-value" -39.006818 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.249581185140063e-18 } }