{ "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" [ [ 1.992263 2.655886 1.517325 ] [ 2.686183 2.997874 4.828117 ] [ 1.135569 3.58045 3.551064 ] [ 3.228076 1.641916 3.257925 ] [ 4.134079 3.318369 1.708542 ] [ 3.231459 4.785804 3.060879 ] [ 4.593203 3.196107 3.900565 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.992263e-10 2.655886e-10 1.517325e-10 ] [ 2.686183e-10 2.997874e-10 4.828117e-10 ] [ 1.135569e-10 3.58045e-10 3.551064e-10 ] [ 3.228076e-10 1.641916e-10 3.257925e-10 ] [ 4.134079e-10 3.318369e-10 1.708542e-10 ] [ 3.231459e-10 4.785804e-10 3.060879e-10 ] [ 4.593203e-10 3.196107e-10 3.900565e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6497553 -0.5940832 -0.2992099 ] [ -1.7602216 0.8700885 7.7525838 ] [ -3.1633886 1.6064178 -2.9596437 ] [ -1.4100842 -7.0518997 -3.844851 ] [ 1.913826 -0.722064 -3.8447272 ] [ -2.5553384 4.3342175 0.7195148 ] [ 8.624962 1.5573231 2.4763332 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.64319937170089e-09 -9.518262138500506e-10 -4.793871064919058e-10 ] [ -2.82018589494717e-09 1.394035452726941e-09 1.242100851515282e-08 ] [ -5.068307257425244e-09 2.573765042396971e-09 -4.741871942038009e-09 ] [ -2.259203938599471e-09 -1.129838883156653e-08 -6.160130382659501e-09 ] [ 3.066287273479181e-09 -1.156874059521331e-09 -6.159932033193846e-09 ] [ -4.094103442712479e-09 6.944181947962225e-09 1.152789790879588e-09 ] [ 1.381871247168841e-08 2.495106661851781e-09 3.96752315835085e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.318444158928926 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.521086890466246e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.8542387 2.4275864 2.0168477 ] [ 2.4268293 2.7866596 4.5355668 ] [ 0.9265074 4.1847555 3.3610913 ] [ 3.7120008 1.3078498 3.0442465 ] [ 4.0867518 3.3018651 1.6313727 ] [ 3.2113274 4.9046444 3.2319415 ] [ 4.7831766 3.2630452 4.0033506 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8542387e-10 2.4275864e-10 2.0168477e-10 ] [ 2.4268293e-10 2.7866596e-10 4.5355668e-10 ] [ 9.265074e-11 4.1847555e-10 3.3610913e-10 ] [ 3.7120008e-10 1.3078498e-10 3.0442465e-10 ] [ 4.0867518e-10 3.3018651e-10 1.6313727e-10 ] [ 3.2113274e-10 4.9046444e-10 3.2319415e-10 ] [ 4.7831766e-10 3.2630452e-10 4.0033506e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.2e-06 -6.9e-06 -1.3e-05 ] [ 6.2e-06 1.2e-06 -4.3e-06 ] [ -4.36e-05 1.49e-05 2.5e-05 ] [ -1.28e-05 -3.02e-05 -1.17e-05 ] [ 1.97e-05 3.8e-06 3.18e-05 ] [ 1.38e-05 -6.2e-06 -1.87e-05 ] [ 9.4e-06 2.33e-05 -9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.153567166976e-14 -1.105501868352e-14 -2.08282960704e-14 ] [ 9.93349504896e-15 1.92261194496e-15 -6.889359469440001e-15 ] [ -6.985490066688e-14 2.387243164992e-14 4.005441552e-14 ] [ -2.050786074624e-14 -4.838573394816e-14 -1.874546646336e-14 ] [ 3.156287942976e-14 6.08827115904e-15 5.094921654144e-14 ] [ 2.211003736704e-14 -9.93349504896e-15 -2.996070280896e-14 ] [ 1.506046023552e-14 3.733071526464e-14 -1.44195895872e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.103202158928926 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.298276105265201e-18 } }