{ "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" [ [ 2.512586 2.352376 3.000619 ] [ 5.747731 2.138199 1.702882 ] [ 4.441387 1.564453 3.266826 ] [ 5.259627 4.180433 2.034508 ] [ 3.39507 3.451757 1.390248 ] [ 4.402652 3.245897 4.59308 ] [ 3.137856 4.41534 3.36482 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.512586e-10 2.352376e-10 3.000619e-10 ] [ 5.747731e-10 2.138199e-10 1.702882e-10 ] [ 4.441387e-10 1.564453e-10 3.266826e-10 ] [ 5.259627e-10 4.180433e-10 2.034508e-10 ] [ 3.39507e-10 3.451757e-10 1.390248e-10 ] [ 4.402652e-10 3.245897e-10 4.59308e-10 ] [ 3.137856000000001e-10 4.41534e-10 3.36482e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.3869249 -4.1229205 0.0958638 ] [ 3.4072764 -2.8245573 -3.6759311 ] [ 2.1808519 -6.703591 2.9316039 ] [ 4.2424924 6.2311793 1.5887202 ] [ -3.3956864 -0.1354324 -8.0078477 ] [ 4.1032532 0.9080264 6.1671918 ] [ -2.1512626 6.6472955 0.9003991 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.343733499518538e-08 -6.605646834517046e-09 1.53590739141047e-10 ] [ 5.45905858868359e-09 -4.525439670169972e-09 -5.889490868091627e-09 ] [ 3.494109927607259e-09 -1.074033677560529e-08 4.696947230026101e-09 ] [ 6.797222137201681e-09 9.98344979447291e-09 2.5454103614327e-09 ] [ -5.440489361648518e-09 -2.169866249788339e-10 -1.282998636786705e-08 ] [ 6.574136346262787e-09 1.454818669149189e-09 9.880930517949469e-09 ] [ -3.446702642921422e-09 1.065014144164905e-08 1.442598387409361e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.985868 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.721436059359486e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3265029 2.1806037 2.7938405 ] [ 5.4406477 2.1257038 1.5707257 ] [ 4.409188 1.372863 3.5555565 ] [ 5.3724006 4.3781194 2.4251072 ] [ 3.4708118 3.4223996 1.0743976 ] [ 4.8508405 3.4492905 4.5868789 ] [ 3.0265175 4.419475 3.3464765 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3265029e-10 2.1806037e-10 2.7938405e-10 ] [ 5.4406477e-10 2.1257038e-10 1.5707257e-10 ] [ 4.409188e-10 1.372863e-10 3.5555565e-10 ] [ 5.3724006e-10 4.3781194e-10 2.4251072e-10 ] [ 3.4708118e-10 3.4223996e-10 1.0743976e-10 ] [ 4.850840500000001e-10 3.4492905e-10 4.586878900000001e-10 ] [ 3.0265175e-10 4.419475e-10 3.3464765e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.33e-05 -5.91e-05 -4e-07 ] [ -2.09e-05 1.67e-05 1.2e-06 ] [ -6.3e-06 3.4e-06 1.18e-05 ] [ 2.71e-05 -4.3e-06 -1.58e-05 ] [ 2.66e-05 1.81e-05 1.9e-06 ] [ 5.6e-06 1e-06 -7.1e-06 ] [ -8.8e-06 2.42e-05 8.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.733071526464e-14 -9.468863828927999e-14 -6.408706483200001e-16 ] [ -3.348549137472e-14 2.675634956736e-14 1.92261194496e-15 ] [ -1.009371271104e-14 5.44740051072e-15 1.890568412544e-14 ] [ 4.341898642368e-14 -6.889359469440001e-15 -2.531439060864e-14 ] [ 4.261789811328e-14 2.899939683648e-14 3.04413557952e-15 ] [ 8.972189076479999e-15 1.6021766208e-15 -1.137545400768e-14 ] [ -1.409915426304e-14 3.877267422336e-14 1.36185012768e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.450209 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.596919999187375e-18 } }