{ "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" [ 5.41852 0 0 ] "si-unit" "m" "si-value" [ 5.418520000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.038783 5.47951 0 ] "si-unit" "m" "si-value" [ 3.8783e-12 5.479510000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.00323821 0.0198894 5.39896 ] "si-unit" "m" "si-value" [ 3.23821e-13 1.98894e-12 5.39896e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0136142 -0.0297439 -0.141562 ] [ 1.34075 1.30471 1.3715 ] [ -0.0280615 2.73239 2.73273 ] [ 1.33689 4.08129 3.93514 ] [ 2.80172 0.157681 2.72105 ] [ 4.07194 1.39009 4.01929 ] [ 2.65272 2.79754 0.0144035 ] [ 4.02421 4.07244 1.32124 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.36142e-12 -2.97439e-12 -1.41562e-11 ] [ 1.34075e-10 1.30471e-10 1.3715e-10 ] [ -2.80615e-12 2.73239e-10 2.73273e-10 ] [ 1.33689e-10 4.08129e-10 3.93514e-10 ] [ 2.80172e-10 1.57681e-11 2.72105e-10 ] [ 4.07194e-10 1.39009e-10 4.01929e-10 ] [ 2.65272e-10 2.79754e-10 1.44035e-12 ] [ 4.02421e-10 4.072440000000001e-10 1.32124e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2507952 -0.6837935 3.3480964 ] [ -1.7344056 2.3398067 -1.7578311 ] [ -0.4770913 -1.2752431 -3.8586173 ] [ 3.4587876 2.9038451 0.6635763 ] [ -3.7675668 -7.3780878 -2.7067862 ] [ 0.7790982 4.6914897 4.9256435 ] [ -0.6703442 -3.7354392 -2.1181862 ] [ 2.6623173 3.1374222 1.5041046 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.018182093593567e-10 -1.095557968181079e-09 5.364241820459518e-09 ] [ -2.77882412619875e-09 3.748783622816648e-09 -2.816355914938517e-09 ] [ -7.643845331446842e-10 -2.043164697489725e-09 -6.182186477608167e-09 ] [ 5.541588674688937e-09 4.652472767975393e-09 1.063166442736174e-09 ] [ -6.03630749399415e-09 -1.182099987676047e-08 -4.33674960287365e-09 ] [ 1.248252931631459e-09 7.516595175991669e-09 7.891750923113978e-09 ] [ -1.074009813977423e-09 -5.984833403967652e-09 -3.39370843610125e-09 ] [ 4.265502570353968e-09 5.026704539832874e-09 2.409841245211916e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.498727 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.687523093614492e-18 } }