{ "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" [ 5.43079 0 0 ] "si-unit" "m" "si-value" [ 5.43079e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0839771 5.43297 0 ] "si-unit" "m" "si-value" [ -8.397710000000001e-12 5.432970000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0398452 0.0785902 5.46584 ] "si-unit" "m" "si-value" [ 3.98452e-12 7.85902e-12 5.46584e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0520054 -0.0817533 0.0407426 ] [ 1.35344 1.3045 1.28849 ] [ 0.00819716 2.75378 2.6961 ] [ 1.33497 4.09637 3.90076 ] [ 2.57675 -0.0301907 2.72622 ] [ 4.09447 1.46101 4.06258 ] [ 2.65601 2.62697 -0.116016 ] [ 4.03834 4.01266 1.20961 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.20054e-12 -8.17533e-12 4.07426e-12 ] [ 1.35344e-10 1.3045e-10 1.28849e-10 ] [ 8.197160000000001e-13 2.75378e-10 2.6961e-10 ] [ 1.33497e-10 4.09637e-10 3.90076e-10 ] [ 2.57675e-10 -3.01907e-12 2.72622e-10 ] [ 4.09447e-10 1.46101e-10 4.06258e-10 ] [ 2.656010000000001e-10 2.62697e-10 -1.16016e-11 ] [ 4.03834e-10 4.012660000000001e-10 1.20961e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.3505356 1.3422036 -2.4365935 ] [ -0.726705 0.4290476 0.5587991 ] [ -0.4302822 -0.7273971 -1.782531 ] [ -1.6296306 -1.395782 3.8871162 ] [ 3.6901966 2.1693413 -2.1960313 ] [ -0.0330305 -1.8101705 -0.1884196 ] [ -0.3856029 1.0484189 -0.0221875 ] [ -1.8354811 -1.0556619 2.1798477 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.163796563878101e-09 2.150447228273595e-09 -3.903853140093245e-09 ] [ -1.164309761218464e-09 6.874100339303501e-10 8.952948537440813e-10 ] [ -6.893880811863898e-10 -1.16541862765772e-09 -2.855929494051245e-09 ] [ -2.610956047860276e-09 -2.236289288133466e-09 6.227846697972936e-09 ] [ 5.91234671867565e-09 3.475667913395879e-09 -3.518430007405031e-09 ] [ -5.29206948733344e-11 -2.900212854761846e-09 -3.018814780204876e-10 ] [ -6.178039512926804e-10 1.679752250384853e-09 -3.554829377399999e-11 ] [ -2.940764906340267e-09 -1.691356815649308e-09 3.492501021844652e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.804872 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.736572882913655e-18 } }