{ "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" [ [ 2.336271 1.731327 1.289714 ] [ 2.769645 4.287083 1.737277 ] [ 4.480326 1.077167 0.108092 ] [ 5.392167 2.307543 2.197028 ] [ 3.12468 2.46702 3.187134 ] [ 4.416093 3.533887 0.3236582 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.336271e-10 1.731327e-10 1.289714e-10 ] [ 2.769645e-10 4.287083e-10 1.737277e-10 ] [ 4.480326e-10 1.077167e-10 1.08092e-11 ] [ 5.392167e-10 2.307543e-10 2.197028e-10 ] [ 3.12468e-10 2.467020000000001e-10 3.187134e-10 ] [ 4.416093e-10 3.533887e-10 3.236582e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.4410105 -1.5131594 -2.2707802 ] [ -0.6119025 1.0488952 0.2333199 ] [ -0.0883173 0.6297268 -0.3567668 ] [ -0.2472185 0.2297585 0.5844371 ] [ 1.6039598 0.5724754 2.3187732 ] [ 0.7844889 -0.9676965 -0.5089832 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.308753352448657e-09 -2.424348634197459e-09 -3.638190977389846e-09 ] [ -9.803758877861849e-10 1.680515380954757e-09 3.738196920272166e-10 ] [ -1.414999144379682e-10 1.008933564763591e-09 -5.716034307469512e-10 ] [ -3.96087704192529e-10 3.68113700162889e-10 9.363714656627213e-10 ] [ 2.569826913435313e-09 9.172067094198034e-10 3.715084240585408e-09 ] [ 1.256889785212363e-09 -1.550420721103581e-09 -8.154809901385486e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -11.462097 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.83643039900415e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1984989 1.1996495 3.7993212 ] [ 2.7437686 3.8927561 1.0013575 ] [ 5.7011921 2.6727238 -1.6883409 ] [ 5.0659753 1.8730695 2.3646038 ] [ 2.8595746 2.5409401 2.9569394 ] [ 4.9501725 3.224888 0.4090221 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1984989e-10 1.1996495e-10 3.7993212e-10 ] [ 2.7437686e-10 3.8927561e-10 1.0013575e-10 ] [ 5.7011921e-10 2.6727238e-10 -1.6883409e-10 ] [ 5.0659753e-10 1.8730695e-10 2.3646038e-10 ] [ 2.8595746e-10 2.5409401e-10 2.9569394e-10 ] [ 4.9501725e-10 3.224888e-10 4.090221e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.7e-06 -9.1e-06 4.6e-06 ] [ 8.9e-06 1.1e-06 -7.8e-06 ] [ -1.3e-06 -1.5e-06 3.8e-06 ] [ 7.9e-06 -2.2e-06 -5.2e-06 ] [ 2e-07 7.2e-06 5.2e-06 ] [ -6e-06 4.6e-06 -6e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.55411133498e-14 -1.45798073694e-14 7.370012516399999e-15 ] [ 1.42593720426e-14 1.7623942974e-15 -1.24969777452e-14 ] [ -2.0828296242e-15 -2.403264951e-15 6.088271209199999e-15 ] [ 1.26571954086e-14 -3.5247885948e-15 -8.331318496799998e-15 ] [ 3.204353268e-16 1.15356717648e-14 8.331318496799998e-15 ] [ -9.613059803999999e-15 7.370012516399999e-15 -9.613059803999998e-16 ] ] } "relaxed-potential-energy" { "source-value" -13.969384 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.238142063617345e-18 } }