{ "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" [ 5.48581 0 0 ] "si-unit" "m" "si-value" [ 5.48581e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00228581 5.44331 0 ] "si-unit" "m" "si-value" [ 2.28581e-13 5.44331e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0206328 -0.0957916 5.42731 ] "si-unit" "m" "si-value" [ -2.06328e-12 -9.57916e-12 5.427310000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00584564 0.00126862 0.0177865 ] [ 1.36937 1.35462 1.37323 ] [ -0.0302415 2.74811 2.64947 ] [ 1.37836 4.07615 4.08107 ] [ 2.65918 -0.0413914 2.54007 ] [ 4.19104 1.29728 4.08084 ] [ 2.79028 2.80414 0.0605432 ] [ 4.08315 4.18517 1.33386 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.845640000000001e-13 1.26862e-13 1.77865e-12 ] [ 1.36937e-10 1.35462e-10 1.37323e-10 ] [ -3.02415e-12 2.74811e-10 2.64947e-10 ] [ 1.37836e-10 4.07615e-10 4.081070000000001e-10 ] [ 2.65918e-10 -4.13914e-12 2.54007e-10 ] [ 4.19104e-10 1.29728e-10 4.08084e-10 ] [ 2.79028e-10 2.80414e-10 6.05432e-12 ] [ 4.08315e-10 4.18517e-10 1.33386e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5895784 0.8962728 -0.3878911 ] [ -0.6522415 1.2540368 -1.4664661 ] [ 0.2886656 -0.1619723 1.2096877 ] [ -0.0033497 -0.6353398 -0.7108931 ] [ 0.5859181 0.4264096 3.4382238 ] [ -1.2854118 0.8304752 -0.5539889 ] [ -0.5421731 -1.0661454 -1.3233716 ] [ 1.0190141 -1.5437369 -0.2053008 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.446087286086707e-10 1.435987326018954e-09 -6.21470051836395e-10 ] [ -1.045006082415523e-09 2.009188442582845e-09 -2.349537700615755e-09 ] [ 4.624932755492045e-10 -2.595082322772039e-10 1.938133351409324e-09 ] [ -5.366811026693761e-12 -1.017926573823748e-09 -1.138976304708036e-09 ] [ 9.387442815235565e-10 6.831834920046797e-10 5.508641789438135e-09 ] [ -2.059456734060446e-09 1.330567949594204e-09 -8.875880637627091e-10 ] [ -8.686570652466604e-10 -1.708153234253464e-09 -2.120275038150689e-09 ] [ 1.632640567285553e-09 -2.473339169846268e-09 -3.289281419915366e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -37.208549 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.961466730169122e-18 } }