{ "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" [ [ 3.1575116 -2.2639521 2.4145847 ] [ -0.5531555 -0.2196442 0.4729299 ] [ 1.7847484 -3.4517771 1.9451754 ] [ 0.5580824 0.5482017 1.3030931 ] [ 0.5638949 0.2649273 -0.7852215 ] [ -1.5523389 1.917655 -3.8482997 ] [ -1.2144949 0.2797533 0.4103356 ] [ -2.744248 2.924836 -1.9125976 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.058891265424801e-09 -3.627251125231064e-09 3.868591155281381e-09 ] [ -8.862528097669344e-10 -3.519088021343194e-10 7.577172290572819e-10 ] [ 2.859482160490207e-09 -5.530356569832824e-09 3.116514549235289e-09 ] [ 8.941465737599539e-10 8.783159472228154e-10 2.087785299545796e-09 ] [ 9.034592253683539e-10 4.244603262716678e-10 -1.258063529449507e-09 ] [ -2.487121093138389e-09 3.072422007760224e-09 -6.165655809171654e-09 ] [ -1.945835334860834e-09 4.482141968516486e-10 6.574301050019405e-10 ] [ -4.396769987277159e-09 4.686103858874189e-09 -3.06431915971819e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.172196240654237 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.591071472376587e-18 } }