{ "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" [ [ 2.743053 2.538085 1.844122 ] [ 1.813323 2.641816 4.57084 ] [ 2.418782 4.209438 3.124504 ] [ 4.81693 2.098767 1.448798 ] [ 3.906107 2.029734 3.728536 ] [ 4.411251 4.516232 1.926861 ] [ 3.723923 4.053892 4.839487 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.743053e-10 2.538085e-10 1.844122e-10 ] [ 1.813323e-10 2.641816e-10 4.57084e-10 ] [ 2.418782e-10 4.209438e-10 3.124504e-10 ] [ 4.81693e-10 2.098767e-10 1.448798e-10 ] [ 3.906107e-10 2.029734e-10 3.728536e-10 ] [ 4.411251e-10 4.516232e-10 1.926861e-10 ] [ 3.723923e-10 4.053892e-10 4.839487000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.2452029 -5.3035051 -5.894924 ] [ -4.7920279 -3.4388102 3.8102199 ] [ -9.5696395 15.4535642 -4.7349054 ] [ 5.9182199 -1.2920339 -1.7965554 ] [ 8.6288511 -11.5422314 3.8771807 ] [ 3.5082726 3.3072629 -1.3088576 ] [ 4.5515267 2.8157534 6.0478418 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.321027142896904e-08 -8.497151949519831e-09 -9.444709492005815e-09 ] [ -7.677675130856087e-09 -5.509581351200866e-09 6.104645294181815e-09 ] [ -1.533225280270344e-08 2.47593394732589e-08 -7.586154796080422e-09 ] [ 9.482033638653815e-09 -2.070066524915892e-09 -2.878399083566523e-09 ] [ 1.38249436106852e-08 -1.849269345330111e-08 6.211928323335763e-09 ] [ 5.620872385422428e-09 5.298819340875078e-09 -2.097021063953318e-09 ] [ 7.292349727767127e-09 4.511334304586056e-09 9.6897108180885e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.562688 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.692329190583219e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4854648 2.2406717 1.7674873 ] [ 1.7246134 2.6935313 4.659742 ] [ 2.4373451 4.4259522 2.9821784 ] [ 4.982974 2.3908407 1.664791 ] [ 3.864924 1.695979 3.7971249 ] [ 4.4373618 4.7226116 1.6491423 ] [ 3.9006858 3.9183775 4.962682 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4854648e-10 2.2406717e-10 1.7674873e-10 ] [ 1.7246134e-10 2.6935313e-10 4.659742e-10 ] [ 2.4373451e-10 4.425952200000001e-10 2.9821784e-10 ] [ 4.982974e-10 2.3908407e-10 1.664791e-10 ] [ 3.864924e-10 1.695979e-10 3.7971249e-10 ] [ 4.4373618e-10 4.7226116e-10 1.6491423e-10 ] [ 3.9006858e-10 3.9183775e-10 4.962682e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0310034 -0.0541715 -0.0317924 ] [ -0.037531 -0.0169482 0.029427 ] [ 0.014334 0.063878 0.025208 ] [ -0.0518657 0.0030417 -0.0154011 ] [ 0.0336914 -0.0103079 0.0093048 ] [ 0.0234611 0.0013404 0.0202896 ] [ -0.0130932 0.0131676 -0.0370358 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.967292305455559e-11 -8.679231152873098e-11 -5.093704041878159e-11 ] [ -6.0131291250654e-11 -2.715401002835879e-11 4.7147251808718e-11 ] [ 2.2965599871756e-11 1.02343839026652e-10 4.0387668589872e-11 ] [ -8.30980126460538e-11 4.8733406676378e-12 -2.46752825578974e-11 ] [ 5.397957384674761e-11 -1.65150765256086e-11 1.49079331440432e-11 ] [ 3.758882622793739e-11 2.1475575602136e-12 3.250752303320639e-11 ] [ -2.09776191042888e-11 2.10968210458584e-11 -5.933789338149719e-11 ] ] } "relaxed-potential-energy" { "source-value" -16.282092 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.608678735503833e-18 } }