{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.421878 2.270641 0.131256 ] [ 0.1151872 2.83342 1.501847 ] [ 1.874433 0.2983712 0.2433776 ] [ 2.499725 0.6406393 2.506935 ] [ 1.789352 2.803582 2.39627 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.21878e-11 2.270641e-10 1.31256e-11 ] [ 1.151872e-11 2.83342e-10 1.501847e-10 ] [ 1.874433e-10 2.983712e-11 2.433776e-11 ] [ 2.499725e-10 6.406393e-11 2.506935e-10 ] [ 1.789352e-10 2.803582e-10 2.39627e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 5.0697721 -8.0415625 -15.9038479 ] [ -12.2128786 6.1386597 11.8858073 ] [ -0.7455984 1.8722617 1.2948075 ] [ -0.9483416 -0.0366022 -1.4342354 ] [ 8.8370465 0.0672433 4.1574685 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.12267039832511e-09 -1.288400353835062e-08 -2.548077349606997e-08 ] [ -1.956718872679863e-08 9.83521713541745e-09 1.904316273228663e-08 ] [ -1.194580334827786e-09 2.999693948473117e-09 2.074510322027955e-09 ] [ -1.519410752570174e-09 -5.86431895929948e-11 -2.297898445535643e-09 ] [ 1.415850941587148e-08 1.077356440530522e-10 6.660998887291028e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.11002004636885054 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.762715475637689e-20 } "relaxed-configuration-positions" { "source-value" [ [ 0.3013887 2.0277661 -0.191226 ] [ -0.0773882 3.5014334 1.5382771 ] [ 1.905884 0.6377516 0.5509957 ] [ 3.0471758 0.4957966 2.4872508 ] [ 1.5235149 2.1839057 2.394388 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.013887e-11 2.0277661e-10 -1.91226e-11 ] [ -7.738820000000001e-12 3.5014334e-10 1.5382771e-10 ] [ 1.905884e-10 6.377516e-11 5.509957e-11 ] [ 3.0471758e-10 4.957966e-11 2.4872508e-10 ] [ 1.5235149e-10 2.1839057e-10 2.394388e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.49e-05 -4.08e-05 3.37e-05 ] [ 1.94e-05 -5.2e-06 3.19e-05 ] [ -3e-05 2.5e-06 -2.49e-05 ] [ -3.98e-05 4.58e-05 -2.04e-05 ] [ -1.45e-05 -2.3e-06 -2.03e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.039812635466e-13 -6.53688066672e-14 5.399335256579999e-14 ] [ 3.10822266996e-14 -8.331318496799998e-15 5.11094346246e-14 ] [ -4.806529901999999e-14 4.005441585e-15 -3.989419818659999e-14 ] [ -6.376663003319999e-14 7.33796898372e-14 -3.26844033336e-14 ] [ -2.3231561193e-14 -3.685006258199999e-15 -3.252418567019999e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.815899046368852 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.732898072779506e-18 } }