{ "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" [ [ 2.019678 3.528357 2.55152 ] [ 4.681874 1.030316 1.978031 ] [ 3.876194 2.698932 0.9098523 ] [ 3.736168 1.84025 3.911189 ] [ 5.498325 3.105138 2.775129 ] [ 3.884183 4.867643 2.227305 ] [ 3.327521 4.019973 4.190113 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.019678e-10 3.528357e-10 2.55152e-10 ] [ 4.681874e-10 1.030316e-10 1.978031e-10 ] [ 3.876194e-10 2.698932e-10 9.098523e-11 ] [ 3.736168e-10 1.84025e-10 3.911189e-10 ] [ 5.498325e-10 3.105138e-10 2.775129000000001e-10 ] [ 3.884183e-10 4.867643e-10 2.227305e-10 ] [ 3.327521e-10 4.019973e-10 4.190113e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.7690458 -1.733668 -2.5036812 ] [ 0.5101749 -3.318424 -0.2564235 ] [ -2.1919349 1.2426832 -3.0159898 ] [ -0.729735 -2.3654755 2.252808 ] [ 3.9642325 1.8137342 0.7337382 ] [ 2.2393173 2.9821021 -2.4240575 ] [ -0.0230091 1.379048 5.2136058 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.038677063484432e-09 -2.777642337829095e-09 -4.011339484576489e-09 ] [ 8.173902972989779e-10 -5.316701350701618e-09 -4.108357367237088e-10 ] [ -3.511866851095586e-09 1.990997970100931e-09 -4.832148346131268e-09 ] [ -1.169164356379488e-09 -3.78990954317519e-09 3.609396308751207e-09 ] [ 6.351400630915536e-09 2.905922531585391e-09 1.175578189827874e-09 ] [ 3.58778182461298e-09 4.777854265458584e-09 -3.883768253974896e-09 ] [ -3.686464208564929e-11 2.209478464560998e-09 8.353117322827281e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.520284 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.845752968977631e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8768227 3.0110219 2.6098238 ] [ 4.747377 1.525381 2.1054035 ] [ 3.3860952 2.9298449 0.8988973 ] [ 3.2919462 1.5510307 3.864048 ] [ 5.7685953 3.3032652 3.109407 ] [ 4.3534775 4.7632665 1.8551955 ] [ 3.5996292 4.0067988 4.1003644 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8768227e-10 3.0110219e-10 2.6098238e-10 ] [ 4.747377e-10 1.525381e-10 2.1054035e-10 ] [ 3.3860952e-10 2.9298449e-10 8.988973e-11 ] [ 3.2919462e-10 1.5510307e-10 3.864048e-10 ] [ 5.768595300000001e-10 3.3032652e-10 3.109407e-10 ] [ 4.353477500000001e-10 4.7632665e-10 1.8551955e-10 ] [ 3.5996292e-10 4.0067988e-10 4.1003644e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.9e-05 1.05e-05 8.3e-06 ] [ 2.57e-05 -2.7e-06 -1.5e-06 ] [ 1.74e-05 2.1e-06 3.85e-05 ] [ -1.83e-05 -9.8e-06 1e-07 ] [ -7.7e-06 -7.7e-06 -5.5e-06 ] [ -1.02e-05 1.91e-05 -9.9e-06 ] [ 1.21e-05 -1.15e-05 -2.99e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.04413557952e-14 1.68228545184e-14 1.329806595264e-14 ] [ 4.117593915456e-14 -4.32587687616e-15 -2.4032649312e-15 ] [ 2.787787320192e-14 3.36457090368e-15 6.16837999008e-14 ] [ -2.931983216064e-14 -1.570133088384e-14 1.6021766208e-16 ] [ -1.233675998016e-14 -1.233675998016e-14 -8.8119714144e-15 ] [ -1.634220153216e-14 3.060157345728e-14 -1.586154854592e-14 ] [ 1.938633711168e-14 -1.84250311392e-14 -4.790508096192e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.445632 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.314445386308035e-18 } }