{ "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" [ 5.33408 0 0 ] "si-unit" "m" "si-value" [ 5.33408e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.034982 5.4373 0 ] "si-unit" "m" "si-value" [ 3.4982e-12 5.437299999999999e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.179208 0.185424 5.40079 ] "si-unit" "m" "si-value" [ 1.79208e-11 1.85424e-11 5.40079e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0492126 -0.0420999 -0.0477888 ] [ 1.41891 1.35069 1.31795 ] [ 0.0600152 2.70621 2.67075 ] [ 1.52388 3.98641 4.19062 ] [ 2.7955 -0.0317733 2.51171 ] [ 4.14719 1.34284 3.96242 ] [ 2.77343 2.76788 -0.181612 ] [ 4.04692 4.12597 1.21449 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.92126e-12 -4.209990000000001e-12 -4.77888e-12 ] [ 1.41891e-10 1.35069e-10 1.31795e-10 ] [ 6.00152e-12 2.70621e-10 2.67075e-10 ] [ 1.52388e-10 3.98641e-10 4.19062e-10 ] [ 2.7955e-10 -3.17733e-12 2.51171e-10 ] [ 4.14719e-10 1.34284e-10 3.96242e-10 ] [ 2.77343e-10 2.76788e-10 -1.81612e-11 ] [ 4.04692e-10 4.12597e-10 1.21449e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.685075 -0.0202159 0.3984072 ] [ -0.4978969 0.4309011 -1.7250515 ] [ 1.5200089 0.7143318 -0.3419762 ] [ -3.1132269 4.2058352 -5.8374668 ] [ -1.5424122 0.3735513 3.5522223 ] [ -1.0722841 0.7112798 -0.9314803 ] [ 1.2199497 -4.2440368 4.227076 ] [ 0.8007865 -2.1716465 0.6582693 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.30196439009456e-09 -3.238944234843072e-11 6.383187013983898e-10 ] [ -7.977187727487955e-10 6.903796682970029e-10 -2.763837182975971e-09 ] [ 2.435322722987925e-09 1.144485709453981e-09 -5.47906272510025e-10 ] [ -4.98793935442566e-09 6.738490828377692e-09 -9.352652831656188e-09 ] [ -2.471216766476694e-09 5.984951595294469e-10 5.691287520944403e-09 ] [ -1.717988515875569e-09 1.1395958664073e-09 -1.49239595939577e-09 ] [ 1.954574887891974e-09 -6.799696538774845e-09 6.772522341544781e-09 ] [ 1.283001408552259e-09 -3.479361250942147e-09 1.054663682650381e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -32.555456 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.215959048268309e-18 } }