{ "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" [ [ 1.743709 2.680969 1.034902 ] [ 2.749822 1.528948 3.390438 ] [ 1.938557 3.742026 2.98984 ] [ 3.932402 1.721019 1.334077 ] [ 5.171354 1.721023 3.429234 ] [ 4.220666 3.803748 1.650722 ] [ 4.237092 3.532846 4.042988 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.743709e-10 2.680969e-10 1.034902e-10 ] [ 2.749822e-10 1.528948e-10 3.390438e-10 ] [ 1.938557e-10 3.742026e-10 2.98984e-10 ] [ 3.932402e-10 1.721019e-10 1.334077e-10 ] [ 5.171354e-10 1.721023e-10 3.429234e-10 ] [ 4.220666e-10 3.803748e-10 1.650722e-10 ] [ 4.237092e-10 3.532846e-10 4.042988e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3347893 -0.4488276 -0.4907126 ] [ -0.6100018 -0.7167308 0.529497 ] [ -0.1455516 0.7293639 1.0469813 ] [ 0.0263937 -2.7450363 -1.3548919 ] [ 0.8287711 -1.9543919 -0.5366662 ] [ 0.4276116 2.7946419 -0.0126076 ] [ -0.8620122 2.3409809 0.8184 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.363915937732161e-10 -7.191010934142982e-10 -7.862082617293883e-10 ] [ -9.773306306579412e-10 -1.148329340628127e-09 8.483477211730979e-10 ] [ -2.331993725613144e-10 1.168569798263112e-09 1.677448975094944e-09 ] [ 4.228736942480579e-11 -4.398033019341814e-09 -2.170776143775864e-09 ] [ 1.327837691354477e-09 -3.131281035858864e-09 -8.598340458975707e-10 ] [ 6.851093139473543e-10 4.477509952577363e-09 -2.01996021308184e-11 ] [ -1.381095805062935e-09 3.75066489862029e-09 1.3112213572656e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -21.448006 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.43634940590918e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1691784 2.6165979 1.3467498 ] [ 2.3083809 1.2861623 3.3759368 ] [ 2.0206746 3.6049533 3.5621575 ] [ 4.4223484 1.7271145 1.1491075 ] [ 4.6138782 1.5579905 3.4579272 ] [ 4.1348257 4.0459452 1.3351404 ] [ 4.3243157 3.8918152 3.6451818 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1691784e-10 2.6165979e-10 1.3467498e-10 ] [ 2.3083809e-10 1.2861623e-10 3.3759368e-10 ] [ 2.0206746e-10 3.6049533e-10 3.5621575e-10 ] [ 4.4223484e-10 1.7271145e-10 1.1491075e-10 ] [ 4.613878200000001e-10 1.5579905e-10 3.4579272e-10 ] [ 4.134825700000001e-10 4.0459452e-10 1.3351404e-10 ] [ 4.3243157e-10 3.8918152e-10 3.6451818e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.9e-06 2.6e-06 1e-05 ] [ -7.4e-06 -6.2e-06 1.08e-05 ] [ -2.11e-05 1.9e-06 -2.3e-06 ] [ 1.73e-05 7.5e-06 -2e-07 ] [ -1.28e-05 1.1e-05 -1.72e-05 ] [ -4.6e-06 -1.09e-05 -4e-06 ] [ 2.18e-05 -6e-06 3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.10550187746e-14 4.165659248399999e-15 1.602176634e-14 ] [ -1.18561070916e-14 -9.9334951308e-15 1.73035076472e-14 ] [ -3.38059269774e-14 3.0441356046e-15 -3.685006258199999e-15 ] [ 2.77176557682e-14 1.2016324755e-14 -3.204353268e-16 ] [ -2.05078609152e-14 1.7623942974e-14 -2.75574381048e-14 ] [ -7.370012516399999e-15 -1.74637253106e-14 -6.408706535999999e-15 ] [ 3.492745062119999e-14 -9.613059803999999e-15 4.806529901999999e-15 ] ] } "relaxed-potential-energy" { "source-value" -22.96247 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.678993289292598e-18 } }