{ "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" [ 5.59774 0 0 ] "si-unit" "m" "si-value" [ 5.597740000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.20689 5.51351 0 ] "si-unit" "m" "si-value" [ -2.0689e-11 5.513510000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.513105 0.215809 5.94806 ] "si-unit" "m" "si-value" [ 5.131050000000001e-11 2.15809e-11 5.94806e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00246673 -0.00144352 -0.0330248 ] [ 1.48237 1.24989 1.2555 ] [ 0.11896 2.3805 2.33914 ] [ 1.62926 4.22989 4.16904 ] [ 2.92639 0.137476 2.28463 ] [ 4.54625 1.57381 3.68026 ] [ 3.00188 2.71108 0.0736878 ] [ 4.22934 4.27512 1.23802 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.46673e-13 -1.44352e-13 -3.30248e-12 ] [ 1.48237e-10 1.24989e-10 1.2555e-10 ] [ 1.1896e-11 2.3805e-10 2.33914e-10 ] [ 1.62926e-10 4.22989e-10 4.16904e-10 ] [ 2.92639e-10 1.37476e-11 2.28463e-10 ] [ 4.54625e-10 1.57381e-10 3.68026e-10 ] [ 3.00188e-10 2.71108e-10 7.36878e-12 ] [ 4.22934e-10 4.27512e-10 1.23802e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.5301517 0.7299934 -3.5337445 ] [ 0.6921739 0.4194159 -4.0923027 ] [ 0.4568828 6.7533195 -0.0611399 ] [ 0.1427328 0.0679756 -0.5309504 ] [ 2.3151327 -2.1409355 4.1130019 ] [ -3.5609696 -2.8463737 5.1088033 ] [ -1.2288311 -0.4467546 -2.6014933 ] [ -0.3472731 -2.5366406 1.5978256 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.451573280017376e-09 1.169578358818303e-09 -5.661682821780586e-09 ] [ 1.108984840107957e-09 6.719783493717907e-10 -6.556591711176717e-09 ] [ 7.320069406056422e-10 1.082001061569274e-08 -9.79569183780499e-11 ] [ 2.286831551813223e-10 1.089089171048525e-10 -8.506763176844083e-10 ] [ 3.70925148598958e-09 -3.430156804740759e-09 6.58975548548598e-09 ] [ -5.705302240499528e-09 -4.560393396199993e-09 8.185205207525889e-09 ] [ -1.968804459331947e-09 -7.157797753548556e-10 -4.168051744427841e-09 ] [ -5.563928418527406e-10 -4.064146264692085e-09 2.559998820435732e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -29.825817 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.778622669365919e-18 } }