{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.418520000000001e-10 0.0 0.0 ] "source-value" [ 5.41852 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 3.8783e-12 5.479510000000001e-10 0.0 ] "source-value" [ 0.038783 5.47951 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 3.23821e-13 1.98894e-12 5.39896e-10 ] "source-value" [ 0.00323821 0.0198894 5.39896 ] } "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" [ [ 3.778161583103174e-10 -3.439663319720275e-10 1.523825377513018e-09 ] [ -9.960925914884716e-10 -4.679810509107687e-10 -1.055081209877762e-09 ] [ 1.391903756732967e-10 2.003348829235353e-10 -1.372786585293581e-09 ] [ 1.341805456194834e-09 6.059619434530233e-10 -7.883836906677044e-10 ] [ -4.312711790866886e-10 -1.418223993824145e-09 -4.075543187866483e-10 ] [ -3.228695110999815e-10 1.137972380837443e-09 2.107170515133842e-09 ] [ -6.243922617750719e-10 -4.119349901032397e-10 1.189967017623955e-10 ] [ 5.158137134894284e-10 6.978371595961785e-10 -1.261866295658976e-10 ] ] "source-value" [ [ 0.2358143 -0.2146869 0.951097 ] [ -0.6217121 -0.2920908 -0.6585299 ] [ 0.0868758 0.1250392 -0.856826 ] [ 0.8374891 0.3782117 -0.4920704 ] [ -0.2691783 -0.8851858 -0.2543754 ] [ -0.2015193 0.7102665 1.3151924 ] [ -0.389715 -0.2571096 0.0742719 ] [ 0.3219456 0.4355557 -0.0787595 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 1.046610982736579e-16 "source-value" 653.2432 } }