{ "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" [ [ 2.147227 2.362862 2.450911 ] [ 2.622761 1.752099 4.557796 ] [ 1.686581 4.667086 2.204349 ] [ 1.229897 3.438837 4.460251 ] [ 4.850673 1.640741 2.950795 ] [ 3.668046 3.670667 2.833872 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.147227e-10 2.362862e-10 2.450911e-10 ] [ 2.622761e-10 1.752099e-10 4.557796e-10 ] [ 1.686581e-10 4.667086e-10 2.204349e-10 ] [ 1.229897e-10 3.438837e-10 4.460251000000001e-10 ] [ 4.850672999999999e-10 1.640741e-10 2.950795e-10 ] [ 3.668046e-10 3.670667e-10 2.833872e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.3420059 -2.6109217 -3.2854809 ] [ -0.4224897 -2.8821458 3.0751128 ] [ -1.1942077 1.8288311 -0.9350595 ] [ -4.5785903 1.6751412 3.8172928 ] [ 3.076856 -1.5019094 -0.418003 ] [ 5.4604377 3.4910046 -2.2538622 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.752307098755663e-09 -4.183157706479392e-09 -5.263920686064944e-09 ] [ -6.769031198688058e-10 -4.617706618496912e-09 4.926873834482827e-09 ] [ -1.91333165731934e-09 2.930110431811947e-09 -1.498130469956938e-09 ] [ -7.335710334881659e-09 2.683872067178857e-09 6.115977278908171e-09 ] [ 4.929666748768205e-09 -2.406324127239755e-09 -6.697146340242625e-10 ] [ 8.748585622274925e-09 5.593205953225256e-09 -3.611085323344854e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.954155 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.755049104161943e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4210091 1.876868 1.9747905 ] [ 2.4584792 1.4668729 4.1574282 ] [ 1.9006147 4.2355011 2.4386842 ] [ 1.4788871 3.6271521 4.7754393 ] [ 4.67498 2.1610508 3.6778154 ] [ 4.2712149 4.1648472 2.4338163 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4210091e-10 1.876868e-10 1.9747905e-10 ] [ 2.4584792e-10 1.4668729e-10 4.1574282e-10 ] [ 1.9006147e-10 4.2355011e-10 2.4386842e-10 ] [ 1.4788871e-10 3.6271521e-10 4.7754393e-10 ] [ 4.67498e-10 2.1610508e-10 3.6778154e-10 ] [ 4.2712149e-10 4.1648472e-10 2.4338163e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.1e-06 1.73e-05 1.98e-05 ] [ 2.1e-05 2.33e-05 -1.06e-05 ] [ -3.87e-05 -3.99e-05 5.1e-06 ] [ 6.5e-06 1.26e-05 -2.89e-05 ] [ -1.64e-05 -3.46e-05 -9.6e-06 ] [ 2.06e-05 2.13e-05 2.42e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.137545400768e-14 2.771765553984e-14 3.172309709184e-14 ] [ 3.36457090368e-14 3.733071526464e-14 -1.698307218048e-14 ] [ -6.200423522496e-14 -6.392684716992e-14 8.17110076608e-15 ] [ 1.04141480352e-14 2.018742542208e-14 -4.630290434112001e-14 ] [ -2.627569658112e-14 -5.543531107968001e-14 -1.538089555968e-14 ] [ 3.300483838848e-14 3.412636202304e-14 3.877267422336e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.186062 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.753510674001929e-18 } }