{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.43182e-10 0.0 0.0 ] "source-value" [ 5.43182 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -4.36542e-13 5.42411e-10 0.0 ] "source-value" [ -0.00436542 5.42411 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.50705e-11 -1.3062e-12 5.36378e-10 ] "source-value" [ 0.250705 -0.013062 5.36378 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -2.168613668106198e-09 7.499976216629434e-10 -1.11701446867842e-09 ] [ 3.033192713199936e-11 -1.432699339157749e-09 3.213578734800228e-09 ] [ -2.958033005741587e-10 9.085535061518497e-10 -2.036186720819946e-09 ] [ 2.066532907323871e-09 -2.470359281549242e-10 -1.160691725973373e-09 ] [ -1.57600025916937e-10 6.177073400424461e-10 5.835080789831597e-10 ] [ -2.341152549053136e-09 -1.527311553622216e-09 1.948567045999298e-09 ] [ 2.901066013812423e-10 -4.127114048936793e-10 -4.759311794773079e-09 ] [ 2.576198107813317e-09 1.343499757971329e-09 3.327550850462133e-09 ] ] "source-value" [ [ -1.3535422 0.4681117 -0.6971856 ] [ 0.0189317 -0.8942206 2.0057581 ] [ -0.1846259 0.5670745 -1.2708878 ] [ 1.2898284 -0.1541877 -0.7244468 ] [ -0.0983662 0.3855426 0.3641971 ] [ -1.4612325 -0.9532729 1.2161999 ] [ 0.1810703 -0.2575942 -2.9705288 ] [ 1.6079364 0.8385466 2.0768939 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 3.36868e-13 -3.47308e-12 7.395090000000001e-12 ] [ 1.33721e-10 1.36002e-10 1.29514e-10 ] [ 8.04819e-12 2.71297e-10 2.74807e-10 ] [ 1.4297e-10 4.00589e-10 4.14244e-10 ] [ 2.76212e-10 -4.29027e-12 2.66501e-10 ] [ 4.31635e-10 1.33651e-10 3.99144e-10 ] [ 2.62716e-10 2.67896e-10 1.44482e-11 ] [ 3.97118e-10 3.97277e-10 1.25678e-10 ] ] "source-value" [ [ 0.00336868 -0.0347308 0.0739509 ] [ 1.33721 1.36002 1.29514 ] [ 0.0804819 2.71297 2.74807 ] [ 1.4297 4.00589 4.14244 ] [ 2.76212 -0.0429027 2.66501 ] [ 4.31635 1.33651 3.99144 ] [ 2.62716 2.67896 0.144482 ] [ 3.97118 3.97277 1.25678 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.502442367559054e-18 "source-value" -21.860526 } }