{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.899847 1.906187 1.523281 ] [ 1.884769 1.70171 3.709853 ] [ 2.49478 3.91064 2.644859 ] [ 3.453021 0.2240813 2.013003 ] [ 4.505277 2.817941 2.046258 ] [ 4.372743 1.259433 3.808578 ] [ 3.775648 3.545824 4.38804 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.899847e-10 1.906187e-10 1.523281e-10 ] [ 1.884769e-10 1.70171e-10 3.709853e-10 ] [ 2.49478e-10 3.91064e-10 2.644859e-10 ] [ 3.453021e-10 2.240813e-11 2.013003e-10 ] [ 4.505277e-10 2.817941e-10 2.046258e-10 ] [ 4.372743e-10 1.259433e-10 3.808578e-10 ] [ 3.775648e-10 3.545824e-10 4.38804e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.8838287 -0.1131206 -2.6507361 ] [ -5.349701 -1.9720422 4.0041544 ] [ -1.6767062 3.1306551 -1.6399852 ] [ 0.4328721 -3.0505122 -2.0351865 ] [ 5.4143239 2.4440541 -3.6313621 ] [ 3.233729 -2.4934231 2.8852231 ] [ 0.829311 2.0543888 3.0678923 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.620402921532057e-09 -1.812391806508685e-10 -4.246947407330571e-09 ] [ -8.571165870470381e-09 -3.159559908070997e-09 6.415362565753452e-09 ] [ -2.686379473590409e-09 5.015862409008286e-09 -2.627545945898012e-09 ] [ 6.935375584165997e-10 -4.887459328305174e-09 -3.260728229267779e-09 ] [ 8.674703170018678e-09 3.915806338990384e-09 -5.818083458279192e-09 ] [ 5.181005001802963e-09 -3.99490419658266e-09 4.622636996612101e-09 ] [ 1.328702695572269e-09 3.291493705393367e-09 4.91530531819234e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.72784 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.359660092288307e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6544111 1.8357168 1.9875084 ] [ 1.2805146 2.2910543 4.2786073 ] [ 2.7641879 3.7352459 1.1177661 ] [ 3.3934355 0.2352371 2.0725384 ] [ 4.9695595 3.562898 2.074178 ] [ 4.8380955 1.5869388 3.368231 ] [ 3.4858809 2.1187255 5.2350428 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6544111e-10 1.8357168e-10 1.9875084e-10 ] [ 1.2805146e-10 2.2910543e-10 4.2786073e-10 ] [ 2.7641879e-10 3.7352459e-10 1.1177661e-10 ] [ 3.3934355e-10 2.352371e-11 2.0725384e-10 ] [ 4.9695595e-10 3.562898e-10 2.074178e-10 ] [ 4.8380955e-10 1.5869388e-10 3.368231e-10 ] [ 3.4858809e-10 2.1187255e-10 5.2350428e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.3e-06 -2.21e-05 -1.11e-05 ] [ 3.8e-05 3e-07 3.1e-06 ] [ -2.1e-06 -0.0 -3.12e-05 ] [ -1.9e-05 7.7e-06 -1.22e-05 ] [ -1.3e-06 9.7e-06 3.42e-05 ] [ -9.6e-06 -6.8e-06 -7.4e-06 ] [ 1.2e-06 1.13e-05 2.45e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.169588933184e-14 -3.540810331968e-14 -1.778416049088e-14 ] [ 6.08827115904e-14 4.8065298624e-16 4.96674752448e-15 ] [ -3.36457090368e-15 0.0 -4.998791056896e-14 ] [ -3.04413557952e-14 1.233675998016e-14 -1.954655477376e-14 ] [ -2.08282960704e-15 1.554111322176e-14 5.479444043136e-14 ] [ -1.538089555968e-14 -1.089480102144e-14 -1.185610699392e-14 ] [ 1.92261194496e-15 1.810459581504e-14 3.92533272096e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.442861 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.435525057726411e-18 } }