{ "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" [ 5.42356 0 0 ] "si-unit" "m" "si-value" [ 5.42356e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0141122 5.36968 0 ] "si-unit" "m" "si-value" [ 1.41122e-12 5.36968e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.125956 0.0899535 5.38067 ] "si-unit" "m" "si-value" [ -1.25956e-11 8.99535e-12 5.380670000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0132742 0.0797855 -0.0480858 ] [ 1.38077 1.28242 1.3281 ] [ 0.0139699 2.87381 2.72647 ] [ 1.34708 4.2887 4.09361 ] [ 2.73598 0.0766444 2.67003 ] [ 4.1072 1.37855 3.98819 ] [ 2.71459 2.70679 -0.0921964 ] [ 4.08895 4.12737 1.11939 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.32742e-12 7.97855e-12 -4.80858e-12 ] [ 1.38077e-10 1.28242e-10 1.3281e-10 ] [ 1.39699e-12 2.873810000000001e-10 2.72647e-10 ] [ 1.34708e-10 4.2887e-10 4.09361e-10 ] [ 2.73598e-10 7.66444e-12 2.67003e-10 ] [ 4.1072e-10 1.37855e-10 3.98819e-10 ] [ 2.71459e-10 2.70679e-10 -9.21964e-12 ] [ 4.08895e-10 4.12737e-10 1.11939e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.4720888 -0.5405393 0.2664247 ] [ -0.9359729 3.3164076 0.5287631 ] [ 0.5618598 -1.0460607 -1.8019587 ] [ -0.6877371 -1.232417 -1.2202256 ] [ 0.7832029 -0.9036109 -0.6869981 ] [ -1.6645629 2.5763764 -0.3468017 ] [ 0.8870032 -1.3722085 0.3014581 ] [ -0.4158817 -0.7979476 2.9593381 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.358546278533099e-09 -8.66039436218716e-10 4.268594290604598e-10 ] [ -1.499593910437219e-09 5.313470765540018e-09 8.471718837414053e-10 ] [ 9.001986431439132e-10 -1.675974011285684e-09 -2.887056124573015e-09 ] [ -1.101876311954921e-09 -1.974549720744378e-09 -1.95501694452863e-09 ] [ 1.254829386061039e-09 -1.44774427020771e-09 -1.100692303422395e-09 ] [ -2.666923784203279e-09 4.127810068469038e-09 -5.556375803714777e-10 ] [ 1.421135801323229e-09 -2.198520395676188e-09 4.829891239500354e-10 ] [ -6.663159422481978e-10 -1.278452999876378e-09 4.741382355925955e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.054827 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.776620136231232e-18 } }