{ "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" [ 5.33408 0 0 ] "si-unit" "m" "si-value" [ 5.33408e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.034982 5.4373 0 ] "si-unit" "m" "si-value" [ 3.4982e-12 5.437299999999999e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.179208 0.185424 5.40079 ] "si-unit" "m" "si-value" [ 1.79208e-11 1.85424e-11 5.40079e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0492126 -0.0420999 -0.0477888 ] [ 1.41891 1.35069 1.31795 ] [ 0.0600152 2.70621 2.67075 ] [ 1.52388 3.98641 4.19062 ] [ 2.7955 -0.0317733 2.51171 ] [ 4.14719 1.34284 3.96242 ] [ 2.77343 2.76788 -0.181612 ] [ 4.04692 4.12597 1.21449 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.92126e-12 -4.209990000000001e-12 -4.77888e-12 ] [ 1.41891e-10 1.35069e-10 1.31795e-10 ] [ 6.00152e-12 2.70621e-10 2.67075e-10 ] [ 1.52388e-10 3.98641e-10 4.19062e-10 ] [ 2.7955e-10 -3.17733e-12 2.51171e-10 ] [ 4.14719e-10 1.34284e-10 3.96242e-10 ] [ 2.77343e-10 2.76788e-10 -1.81612e-11 ] [ 4.04692e-10 4.12597e-10 1.21449e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.8720109 -0.3863594 -0.0249582 ] [ 0.2311004 -0.4027705 1.2548807 ] [ -0.2071568 -0.835587 0.4644279 ] [ 2.9078786 -3.4140123 3.8597128 ] [ 1.1845012 0.1008603 -2.3348372 ] [ 0.8137989 -0.5162551 0.3346473 ] [ -2.4067567 3.6745861 -2.8479444 ] [ -0.6513548 1.7795379 -0.705929 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.99929212257331e-09 -6.190160030062595e-10 -3.998744486669879e-11 ] [ 3.702636609880536e-10 -6.453094839644969e-10 2.010540535997563e-09 ] [ -3.319017845342111e-10 -1.338757967074158e-09 7.440955295576885e-10 ] [ 4.658935147428632e-09 -5.469850735248598e-09 6.183941662110715e-09 ] [ 1.89778014558496e-09 1.615960159582302e-10 -3.740821606033984e-09 ] [ 1.303849582354903e-09 -8.271318584033332e-10 5.361640846911881e-10 ] [ -3.856049348462947e-09 5.887335989041187e-09 -4.562909972611149e-09 ] [ -1.043585441003743e-09 2.851134042697428e-09 -1.131022949062986e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 0.030054398437521 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.815245492552226e-21 } }