{ "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" [ [ 4.54788 -3.0066089 3.6838704 ] [ -0.6702398 -0.219359 0.7394144 ] [ 2.7196885 -4.3894975 2.5557153 ] [ 0.5848156 0.6679923 1.6877758 ] [ 0.6579994 0.3765023 -1.1733651 ] [ -2.3465898 2.5923966 -5.5884449 ] [ -1.4611501 0.095063 0.7749149 ] [ -4.0324038 3.8835112 -2.6798808 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.286507010203905e-09 -4.817118487469205e-09 5.902211028937144e-09 ] [ -1.073842537889668e-09 -3.514518613620672e-10 1.18467246476286e-09 ] [ 4.357421330558622e-09 -7.032750271560048e-09 4.094707303080859e-09 ] [ 9.369778817991245e-10 1.07024164593442e-09 2.704114927912017e-09 ] [ 1.054231255180428e-09 6.032231827374278e-10 -1.879938130882654e-09 ] [ -3.759651316167748e-09 4.153477224361409e-09 -8.953675765408994e-09 ] [ -2.341020529699582e-09 1.523077161031104e-10 1.24155053588957e-09 ] [ -6.460623093985079e-09 6.222070851254953e-09 -4.2936423642908e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.569192 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.53859512223464e-18 } }