{ "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" [ [ 2.674789 2.922951 1.929928 ] [ 1.975006 0.6488867 2.865648 ] [ 2.721706 2.680777 4.242411 ] [ 4.506989 0.6613651 2.267837 ] [ 4.914488 1.931532 3.86875 ] [ 3.976236 4.774813 0.5862588 ] [ 4.03158 4.218687 2.874326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.674789e-10 2.922951e-10 1.929928e-10 ] [ 1.975006e-10 6.488867e-11 2.865648e-10 ] [ 2.721706e-10 2.680777e-10 4.242411e-10 ] [ 4.506989e-10 6.613651e-11 2.267837e-10 ] [ 4.914488e-10 1.931532e-10 3.86875e-10 ] [ 3.976236e-10 4.774813e-10 5.862588e-11 ] [ 4.03158e-10 4.218687e-10 2.874326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.6742601 -3.2973511 -6.0849049 ] [ 1.7641485 -0.1268305 0.1421963 ] [ -2.1120155 -1.2674767 3.8177221 ] [ -2.805779 -2.2478868 -2.9882654 ] [ 1.9638312 2.100727 3.1015719 ] [ -0.053207 0.1767922 -1.1023313 ] [ 4.9172819 4.6620258 3.1140113 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.88681363095827e-09 -5.282938842989163e-09 -9.749092370571362e-09 ] [ 2.826477482319389e-09 -2.032048619043744e-10 2.27823587424263e-10 ] [ -3.383821856867223e-09 -2.030721536148736e-09 6.11666509333148e-09 ] [ -4.495353516931602e-09 -3.601511677164925e-09 -4.787728960625561e-09 ] [ 3.146404435837609e-09 3.365735686083322e-09 4.969265985910236e-09 ] [ -8.52470114629056e-11 2.832523295797977e-10 -1.766129437236071e-09 ] [ 7.878354098063004e-09 7.469388742326417e-09 4.989196101767015e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.653378 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.988600613054506e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.774747 2.6599261 1.6225182 ] [ 2.5044183 0.6080045 3.4110451 ] [ 2.3258908 3.006182 4.1784162 ] [ 4.2562924 0.6117837 1.6516639 ] [ 4.689149 1.9405172 3.7451566 ] [ 4.0440981 4.6250511 0.8101859 ] [ 4.2061984 4.3875471 3.216173 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.774747e-10 2.6599261e-10 1.6225182e-10 ] [ 2.504418300000001e-10 6.080045e-11 3.4110451e-10 ] [ 2.3258908e-10 3.006182e-10 4.1784162e-10 ] [ 4.2562924e-10 6.117837e-11 1.6516639e-10 ] [ 4.689149e-10 1.9405172e-10 3.7451566e-10 ] [ 4.0440981e-10 4.6250511e-10 8.101859000000001e-11 ] [ 4.2061984e-10 4.3875471e-10 3.216173e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.03e-05 1.93e-05 -3.31e-05 ] [ -3.9e-06 -3.2e-06 1.83e-05 ] [ -1.86e-05 1.12e-05 2.75e-05 ] [ 2.2e-05 -1.94e-05 -2.48e-05 ] [ 1.59e-05 -2.9e-06 5.8e-06 ] [ 8.8e-06 -8.5e-06 -4.2e-06 ] [ -3.8e-06 3.4e-06 1.05e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.252418540224e-14 3.092200878144e-14 -5.303204614848e-14 ] [ -6.24848882112e-15 -5.126965186560001e-15 2.931983216064e-14 ] [ -2.980048514688e-14 1.794437815296e-14 4.4059857072e-14 ] [ 3.52478856576e-14 -3.108222644352e-14 -3.973398019584e-14 ] [ 2.547460827072e-14 -4.646312200320001e-15 9.292624400640001e-15 ] [ 1.409915426304e-14 -1.36185012768e-14 -6.72914180736e-15 ] [ -6.08827115904e-15 5.44740051072e-15 1.68228545184e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.73853 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.643114115735942e-18 } }