{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.05393e-09 0.0 0.0 ] "source-value" [ 10.5393 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -5.438869999999999e-10 9.05087e-10 0.0 ] "source-value" [ -5.43887 9.05087 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.43218e-11 -1.14794e-11 1.05272e-09 ] "source-value" [ -0.143218 -0.114794 10.5272 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "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" 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1.6529885 ] [ -0.1369043 -1.0100384 0.4800193 ] [ -0.2342396 1.6533317 0.083405 ] [ 1.8793868 -1.9139126 -0.0921724 ] [ -2.5574644 1.758274 0.2809726 ] [ -1.1526685 -0.377481 0.0244922 ] [ 1.8989288 -2.2860684 -0.1992323 ] [ -1.0728714 1.7190726 0.2735076 ] [ 0.3050823 -0.0798499 0.2926912 ] [ -0.440278 0.2060695 -0.2168518 ] [ -1.3897795 -0.1039271 -0.2378202 ] [ 2.5518554 0.3827651 0.2051221 ] [ 1.038119 -1.2218805 -0.0970127 ] [ -2.3355117 -0.7813849 -1.249631 ] [ -1.3360132 -0.3459019 1.3400312 ] [ -0.11454 -0.6536733 -1.5118431 ] [ -4.016847 0.8613101 0.7722874 ] [ -2.8792973 -2.808395 1.4569342 ] [ -0.6291734 -1.4874194 -0.2792238 ] [ -0.8413564 1.554883 -0.3373367 ] [ 1.3521744 1.6752141 -1.5638414 ] [ -1.5511715 1.3288093 2.1008231 ] [ -5.2538812 0.9659367 -1.155874 ] [ 1.8623697 -0.8828566 0.3800489 ] [ 0.1885644 0.1051809 -0.5682825 ] [ 1.5428523 0.1186052 -0.4223057 ] [ 0.4084339 -2.3645528 0.7184759 ] [ -0.6012534 0.9145682 -0.7710578 ] [ 1.4325576 -4.4074887 0.3248674 ] [ 1.0416448 -0.6776468 -0.3274019 ] [ 0.5128983 0.4051407 0.854576 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 4.94125e-12 -1.32091e-11 -1.11737e-11 ] [ -1.84353e-11 4.30984e-13 2.1810200000000002e-10 ] [ -1.1482000000000001e-11 3.8029400000000006e-11 5.25782e-10 ] [ -2.44788e-11 1.40152e-12 7.75205e-10 ] [ -1.34009e-10 2.2554699999999999e-10 9.20874e-13 ] [ -1.26592e-10 1.82964e-10 2.63403e-10 ] [ -1.6022000000000002e-10 2.11686e-10 4.861060000000001e-10 ] [ -1.6679600000000003e-10 2.1917900000000003e-10 8.112510000000001e-10 ] [ -2.4686e-10 4.6549500000000006e-10 -3.9812500000000003e-13 ] [ -2.7623700000000005e-10 4.7379e-10 2.1480500000000001e-10 ] [ -2.48563e-10 4.61278e-10 5.50478e-10 ] [ -2.70397e-10 4.5148000000000003e-10 8.08626e-10 ] [ -3.98412e-10 6.86221e-10 -4.28531e-12 ] [ -3.96331e-10 6.85194e-10 2.77309e-10 ] [ -4.2696e-10 6.9471e-10 5.55519e-10 ] [ -4.05263e-10 6.79882e-10 8.03872e-10 ] [ 2.63278e-10 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