{ "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" [ 5.39006 0 0 ] "si-unit" "m" "si-value" [ 5.39006e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.23331 5.36322 0 ] "si-unit" "m" "si-value" [ 2.3331e-11 5.36322e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.160148 -0.0213292 5.4933 ] "si-unit" "m" "si-value" [ -1.60148e-11 -2.13292e-12 5.4933e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.105355 0.0424721 -0.0304949 ] [ 1.33629 1.36991 1.45967 ] [ -0.05353 2.71357 2.83859 ] [ 1.26119 4.17265 4.20892 ] [ 2.69817 -0.0783338 2.63037 ] [ 3.99124 1.24872 4.05842 ] [ 2.76699 2.61469 0.0747626 ] [ 4.02836 3.96527 1.47431 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.05355e-11 4.24721e-12 -3.04949e-12 ] [ 1.33629e-10 1.36991e-10 1.45967e-10 ] [ -5.353e-12 2.71357e-10 2.83859e-10 ] [ 1.26119e-10 4.17265e-10 4.20892e-10 ] [ 2.69817e-10 -7.83338e-12 2.63037e-10 ] [ 3.99124e-10 1.24872e-10 4.05842e-10 ] [ 2.76699e-10 2.61469e-10 7.47626e-12 ] [ 4.02836e-10 3.96527e-10 1.47431e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.0656796 1.8532594 4.9473229 ] [ 0.2764659 0.1245125 -0.9473464 ] [ 0.65302 -0.3606354 0.4868821 ] [ 4.9931524 -4.7865809 -4.0729795 ] [ -4.2999044 3.027938 4.7447819 ] [ -0.4163783 1.0548637 0.7092395 ] [ -0.7132169 0.5944934 -1.0047199 ] [ 4.5725409 -1.5078507 -4.8631806 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.116113490450466e-09 2.969248907420859e-09 7.926485151233117e-09 ] [ 4.429472050777805e-10 1.99491018140925e-10 -1.517816266384017e-09 ] [ 1.04625338553468e-09 -5.778016112732436e-10 7.800711241328513e-10 ] [ 7.99991210528102e-09 -7.66894807473069e-09 -6.525632585661001e-09 ] [ -6.889206358113789e-09 4.851291512800691e-09 7.601978693606124e-09 ] [ -6.671115831646422e-10 1.690077972194786e-09 1.136326954809843e-09 ] [ -1.142699452153914e-09 9.524834345472155e-10 -1.609738747494816e-09 ] [ 7.32601818798933e-09 -2.415843159100544e-09 -7.7916743242421e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.576607 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.539783181840084e-18 } }