{ "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" [ [ 1.26541 0.4689135 1.770405 ] [ 0.1075881 2.160004 0.6716672 ] [ 0.5668509 2.899878 2.242644 ] [ 2.824031 1.222886 2.646945 ] [ 2.932592 2.399832 0.52394 ] [ 1.820297 2.092873 2.325497 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.26541e-10 4.689135e-11 1.770405e-10 ] [ 1.075881e-11 2.160004e-10 6.716672e-11 ] [ 5.668509000000001e-11 2.899878e-10 2.242644e-10 ] [ 2.824031e-10 1.222886e-10 2.646945e-10 ] [ 2.932592e-10 2.399832e-10 5.2394e-11 ] [ 1.820297e-10 2.092873e-10 2.325497e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -24.732895 -81.5386956 -7.2782685 ] [ -39.9030092 -0.5306985 -41.5949956 ] [ -85.9127937 80.6441315 27.8553178 ] [ 95.6760185 -69.5786738 44.8267589 ] [ 44.9578324 21.1145553 -43.8346128 ] [ 9.9148469 49.8893811 20.0258003 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.962646613370122e-08 -1.306393917808478e-07 -1.166107163060509e-08 ] [ -6.393166843980732e-08 -8.502727293936288e-10 -6.664252949259887e-08 ] [ -1.376474694937535e-07 1.292061420940208e-07 4.462913894411409e-08 ] [ 1.532898800119283e-07 -1.114773244686295e-07 7.182038509581832e-08 ] [ 7.203038799312476e-08 3.382924686024873e-08 -7.023079180998043e-08 ] [ 1.588533590199136e-08 7.993160002460139e-08 3.208486905346963e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 104.50501 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.674354837784702e-17 } "relaxed-configuration-positions" { "source-value" [ [ 1.0487834 -0.1956905 1.5286938 ] [ 0.3387345 1.7998177 0.4249927 ] [ 0.1759965 3.2320087 2.4656682 ] [ 2.6858705 0.6368481 3.0609626 ] [ 2.6091995 2.7920614 0.1049397 ] [ 2.6581846 2.9793409 2.5958412 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0487834e-10 -1.956905e-11 1.5286938e-10 ] [ 3.387345e-11 1.7998177e-10 4.249927e-11 ] [ 1.759965e-11 3.2320087e-10 2.4656682e-10 ] [ 2.6858705e-10 6.368481e-11 3.0609626e-10 ] [ 2.6091995e-10 2.7920614e-10 1.049397e-11 ] [ 2.6581846e-10 2.9793409e-10 2.5958412e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.16e-05 1.2e-06 3.31e-05 ] [ 4.17e-05 2.49e-05 3.4e-05 ] [ 3.57e-05 -3.2e-05 -4e-06 ] [ 1.5e-06 1.23e-05 -6.11e-05 ] [ 2.25e-05 -1.14e-05 7.57e-05 ] [ -7.98e-05 4.9e-06 -7.76e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.460701500928e-14 1.92261194496e-15 5.303204614848e-14 ] [ 6.681076508736e-14 3.989419785791999e-14 5.44740051072e-14 ] [ 5.719770536256001e-14 -5.12696518656e-14 -6.4087064832e-15 ] [ 2.4032649312e-15 1.970677243584e-14 -9.789299153088e-14 ] [ 3.604897396800001e-14 -1.826481347712e-14 1.2128477019456e-13 ] [ -1.2785369433984e-13 7.850665441919999e-15 -1.2432890577408e-13 ] ] } "relaxed-potential-energy" { "source-value" -14.021911 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.246557798313835e-18 } }