{ "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" [ 5.40034 0 0 ] "si-unit" "m" "si-value" [ 5.40034e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00680429 5.47714 0 ] "si-unit" "m" "si-value" [ -6.804290000000001e-13 5.477140000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0750519 0.000428382 5.30288 ] "si-unit" "m" "si-value" [ 7.50519e-12 4.28382e-14 5.30288e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0542923 -0.0551564 0.0107349 ] [ 1.38568 1.34449 1.49834 ] [ -0.0627007 2.68919 2.77312 ] [ 1.41517 4.13638 3.9375 ] [ 2.74489 -0.0643812 2.6522 ] [ 4.02561 1.44985 4.00224 ] [ 2.7219 2.73875 0.136559 ] [ 4.01026 4.10579 1.40939 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.429230000000001e-12 -5.51564e-12 1.07349e-12 ] [ 1.38568e-10 1.34449e-10 1.49834e-10 ] [ -6.27007e-12 2.68919e-10 2.77312e-10 ] [ 1.41517e-10 4.13638e-10 3.9375e-10 ] [ 2.74489e-10 -6.43812e-12 2.6522e-10 ] [ 4.025610000000001e-10 1.44985e-10 4.00224e-10 ] [ 2.7219e-10 2.73875e-10 1.36559e-11 ] [ 4.01026e-10 4.10579e-10 1.40939e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3953499 1.1960244 0.3697221 ] [ -1.120098 0.0308388 -1.6274006 ] [ 1.5654082 1.5795684 -1.4715418 ] [ -0.5837719 -1.4108895 1.6353005 ] [ 0.0684491 1.6480219 1.2146356 ] [ -0.3377153 -2.5130976 1.208626 ] [ -1.5635779 0.223096 -0.8112631 ] [ 1.5759558 -0.7535624 -0.5180788 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.334203720342365e-10 1.916242347373869e-09 5.923601096934113e-10 ] [ -1.794594843390132e-09 4.940920478059919e-11 -2.60738321547758e-09 ] [ 2.508060440711998e-09 2.530747582284765e-09 -2.357669887914301e-09 ] [ -9.353056977657846e-10 -2.260494190055942e-09 2.620040250668517e-09 ] [ 1.096675486383294e-10 2.640422180500285e-09 1.94606077714457e-09 ] [ -5.410795626043002e-10 -4.026426253681478e-09 1.936432336444884e-09 ] [ -2.505127976818789e-09 3.57439198338864e-10 -1.299786782846405e-09 ] [ 2.524959558976777e-09 -1.207340069540961e-09 -8.30053747930759e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -36.246688 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.807359657348819e-18 } }