{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.8495841 0.5267621 0.8966685 ] [ 0.1884113 0.623136 2.979456 ] [ 1.483282 2.75051 2.967402 ] [ 1.97645 1.30316 2.052926 ] [ 2.403862 2.938822 1.215589 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.495841e-11 5.267621e-11 8.966685e-11 ] [ 1.884113e-11 6.23136e-11 2.979456e-10 ] [ 1.483282e-10 2.75051e-10 2.967402e-10 ] [ 1.97645e-10 1.30316e-10 2.052926e-10 ] [ 2.403862e-10 2.938822e-10 1.215589e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -18.6022254 -26.5666759 -32.3939791 ] [ -20.4835923 -11.0767183 15.4672231 ] [ -6.2046942 34.8669576 32.7981878 ] [ 30.5356633 -22.9089199 3.2463864 ] [ 14.7548486 25.6853566 -19.1178181 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.980405063073193e-08 -4.25645070193508e-08 -5.190087596870383e-08 ] [ -3.28183326930589e-08 -1.774685909544752e-08 2.47812232395177e-08 ] [ -9.941015986453359e-09 5.586302430514488e-08 5.254848969776778e-08 ] [ 4.892352583988058e-08 -3.670413587155988e-08 5.201284392163077e-09 ] [ 2.363987347036361e-08 4.115247784143098e-08 -3.063012120052708e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 30.967324 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.961512252153874e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8474041 -0.1926278 1.3878531 ] [ -0.3172241 1.1219223 2.9523741 ] [ 0.864094 3.1365146 3.2317159 ] [ 2.7484986 1.0095305 0.7002617 ] [ 2.7588168 3.0670505 1.8398367 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.474041e-11 -1.926278e-11 1.3878531e-10 ] [ -3.172241e-11 1.1219223e-10 2.9523741e-10 ] [ 8.64094e-11 3.1365146e-10 3.2317159e-10 ] [ 2.7484986e-10 1.0095305e-10 7.002617e-11 ] [ 2.7588168e-10 3.0670505e-10 1.8398367e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 -5e-07 -8e-07 ] [ -1.5e-06 -1.1e-06 7e-07 ] [ 2e-06 -1.4e-06 -2e-06 ] [ -1.9e-06 -5e-07 1.7e-06 ] [ 1.3e-06 3.5e-06 4e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 -8.010883104e-16 -1.28174129664e-15 ] [ -2.4032649312e-15 -1.76239428288e-15 1.12152363456e-15 ] [ 3.2043532416e-15 -2.24304726912e-15 -3.2043532416e-15 ] [ -3.04413557952e-15 -8.010883104e-16 2.72370025536e-15 ] [ 2.08282960704e-15 5.6076181728e-15 6.408706483200001e-16 ] ] } "relaxed-potential-energy" { "source-value" -10.83321 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.735671579021677e-18 } }