{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.33088 0 0 ] "si-unit" "m" "si-value" [ 5.33088e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0480326 5.46857 0 ] "si-unit" "m" "si-value" [ 4.80326e-12 5.46857e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.109209 0.182969 5.33745 ] "si-unit" "m" "si-value" [ -1.09209e-11 1.82969e-11 5.33745e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0970486 -0.0788825 -0.10937 ] [ 1.39157 1.38931 1.26283 ] [ -0.0444574 2.82173 2.6602 ] [ 1.24826 4.17435 3.90061 ] [ 2.67605 0.0682538 2.80056 ] [ 3.9766 1.50429 4.31462 ] [ 2.81042 2.80539 0.0255717 ] [ 4.1826 4.03217 1.44291 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -9.70486e-12 -7.88825e-12 -1.0937e-11 ] [ 1.39157e-10 1.38931e-10 1.26283e-10 ] [ -4.44574e-12 2.82173e-10 2.6602e-10 ] [ 1.24826e-10 4.17435e-10 3.90061e-10 ] [ 2.67605e-10 6.825380000000001e-12 2.80056e-10 ] [ 3.9766e-10 1.50429e-10 4.31462e-10 ] [ 2.81042e-10 2.80539e-10 2.55717e-12 ] [ 4.1826e-10 4.03217e-10 1.44291e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 16.2118554 -14.875209 13.6380298 ] [ -2.551598 -0.2707206 0.6610769 ] [ 10.011287 -16.4023639 11.1106981 ] [ 0.2292117 1.3880983 4.1318811 ] [ 3.4097257 1.1548279 -1.8903896 ] [ -10.3389773 12.6061559 -19.0494661 ] [ -3.043494 1.9748426 2.9758009 ] [ -13.9280105 14.4243688 -11.5776311 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.597425591566672e-08 -2.38327122856665e-08 2.185053267935569e-08 ] [ -4.088110694961131e-09 -4.337422196624603e-10 1.059161962457154e-09 ] [ 1.603985010766795e-08 -2.627948418294511e-08 1.78013008832482e-08 ] [ 3.672376299794177e-10 2.223978661955122e-09 6.620003352886217e-09 ] [ 5.462982844889294e-09 1.850238277671288e-09 -3.028738046276606e-09 ] [ -1.656486784951641e-08 2.019728842754124e-08 -3.052060947559511e-08 ] [ -4.876214972519196e-09 3.164046669547808e-09 4.76775866941617e-09 ] [ -2.231513298120666e-08 2.311038665155861e-08 -1.854941002549172e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -29.759466 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.767992106551744e-18 } }