{ "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" [ [ 0.7859888 0.7922848 0.3283142 ] [ 1.326446 2.971813 1.139898 ] [ 0.4302915 2.603801 2.617302 ] [ 2.920361 1.53739 0.8701039 ] [ 1.870212 1.959004 2.746341 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.859888e-11 7.922848000000001e-11 3.283142e-11 ] [ 1.326446e-10 2.971813e-10 1.139898e-10 ] [ 4.302915e-11 2.603801e-10 2.617302e-10 ] [ 2.920361000000001e-10 1.53739e-10 8.701039000000001e-11 ] [ 1.870212e-10 1.959004e-10 2.746341e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.1860002 -3.7121474 -4.1627092 ] [ -9.8760037 42.0018332 -67.1080562 ] [ -89.9826645 29.8161628 11.5694398 ] [ 12.0994644 -5.0721169 -6.6946482 ] [ 92.945204 -63.0337317 66.3959738 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.308888344359325e-09 -5.947515826243851e-09 -6.669395414376833e-09 ] [ -1.582310236543754e-08 6.729435573820544e-08 -1.075189595967988e-07 ] [ -1.441681225269613e-07 4.777075935370001e-08 1.853628611602963e-08 ] [ 1.938547914559483e-08 -8.126427182096514e-09 -1.072600891889016e-08 ] [ 1.489146340911633e-07 -1.009911720835651e-07 1.063780778140362e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 35.058494 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.616989991002919e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.285875 -0.1202823 -0.275107 ] [ 1.0201593 3.6591135 0.6586442 ] [ 0.5289543 3.3875663 3.1813823 ] [ 2.4540565 1.6415575 0.8562369 ] [ 2.0442542 1.2963377 3.2808028 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.285875e-10 -1.202823e-11 -2.75107e-11 ] [ 1.0201593e-10 3.6591135e-10 6.586442e-11 ] [ 5.289543e-11 3.3875663e-10 3.1813823e-10 ] [ 2.4540565e-10 1.6415575e-10 8.562369e-11 ] [ 2.0442542e-10 1.2963377e-10 3.2808028e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.22e-05 7.9e-06 1.72e-05 ] [ 9.6e-06 -3.38e-05 6.9e-06 ] [ 1.56e-05 4e-07 1.52e-05 ] [ -9e-06 1.69e-05 -1.15e-05 ] [ -2.83e-05 8.7e-06 -2.79e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.95465549348e-14 1.26571954086e-14 2.75574381048e-14 ] [ 1.53808956864e-14 -5.415357022919999e-14 1.10550187746e-14 ] [ 2.49939554904e-14 6.408706536e-16 2.43530848368e-14 ] [ -1.4419589706e-14 2.70767851146e-14 -1.8425031291e-14 ] [ -4.53415987422e-14 1.39389367158e-14 -4.470072808859999e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.90107 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.227196954159838e-18 } }