{ "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" [ [ -0.7797314 9.169307 -4.8415364 ] [ -4.5496672 4.6081733 -9.9509493 ] [ -4.0932064 2.0774622 5.0129628 ] [ -0.6438022 1.2264563 -5.2060658 ] [ 13.1669183 -13.3822422 6.90276 ] [ 2.4412844 -4.7136485 -4.8874472 ] [ 0.0586725 -0.6895144 6.1896061 ] [ -5.6004681 1.7040062 6.7806698 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.249267419583653e-09 1.469084930433779e-08 -7.756996428832198e-09 ] [ -7.289370420260598e-09 7.383107525854785e-09 -1.594317832322612e-08 ] [ -6.558039598188933e-09 3.328461367435734e-09 8.031651799100107e-09 ] [ -1.031484833259606e-09 1.964999610292871e-09 -8.341036911106448e-09 ] [ 2.109572866824368e-08 -2.144071558672316e-08 1.105944069099341e-08 ] [ 3.911368790403755e-09 -7.552097425368989e-09 -7.830553639234423e-09 ] [ 9.400370778388801e-11 -1.104723851384939e-09 9.916842185381066e-09 ] [ -8.972939055356196e-09 2.730118895338249e-09 1.086383062692461e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -29.540244 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.732868830952748e-18 } }