{ "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" [ 5.39854 0 0 ] "si-unit" "m" "si-value" [ 5.39854e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0197648 5.43736 0 ] "si-unit" "m" "si-value" [ 1.97648e-12 5.43736e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0299081 -0.213673 5.1785 ] "si-unit" "m" "si-value" [ -2.99081e-12 -2.13673e-11 5.1785e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.157946 -0.285755 0.37808 ] [ 1.35651 1.53389 1.4884 ] [ 0.00292057 2.68505 2.57873 ] [ 1.38402 4.09726 4.02157 ] [ 2.45639 0.443756 2.59681 ] [ 4.09137 1.38211 4.21726 ] [ 2.67291 2.94824 -0.16912 ] [ 4.08439 3.99712 1.2513 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.57946e-11 -2.85755e-11 3.780800000000001e-11 ] [ 1.35651e-10 1.53389e-10 1.4884e-10 ] [ 2.92057e-13 2.68505e-10 2.57873e-10 ] [ 1.38402e-10 4.097260000000001e-10 4.02157e-10 ] [ 2.45639e-10 4.43756e-11 2.59681e-10 ] [ 4.091370000000001e-10 1.38211e-10 4.21726e-10 ] [ 2.67291e-10 2.94824e-10 -1.6912e-11 ] [ 4.08439e-10 3.99712e-10 1.2513e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.2223634 12.8614777 -2.310051 ] [ -18.9424585 17.8697782 -27.8730837 ] [ -4.7722997 4.6538922 5.6366708 ] [ -1.4492214 3.5153032 -8.7464226 ] [ 26.6088705 -27.7639087 26.4024154 ] [ 4.2947774 -5.868873 -6.2615569 ] [ -1.4485211 -1.8994987 7.7715869 ] [ -7.5135106 -3.3681708 5.3804411 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.162795345736794e-09 2.060635904965206e-08 -3.701109735548333e-09 ] [ -3.034916439921469e-08 2.863054108680257e-08 -4.465760342166625e-08 ] [ -7.646067069785209e-09 7.456357339994853e-09 9.030942249310086e-09 ] [ -2.321908664572767e-09 5.632136648465428e-09 -1.401331392080953e-08 ] [ 4.263211057223189e-08 -4.448268578764931e-08 4.230133303504175e-08 ] [ 6.880991998511271e-09 -9.40297118851348e-09 -1.003212015764147e-08 ] [ -2.320786660275977e-09 -3.043332433453376e-09 1.245145494028049e-08 ] [ -1.203797112263132e-08 -5.396404555081087e-09 8.620417011033255e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -24.770026 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.968595688077248e-18 } }