{ "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" [ 5.31945 0 0 ] "si-unit" "m" "si-value" [ 5.31945e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00383334 5.41695 0 ] "si-unit" "m" "si-value" [ -3.83334e-13 5.416950000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0189848 -0.118491 5.47074 ] "si-unit" "m" "si-value" [ 1.89848e-12 -1.18491e-11 5.47074e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0147515 -0.0960157 0.0381768 ] [ 1.54242 1.27348 1.38773 ] [ -0.0738039 2.51333 2.6891 ] [ 1.45374 4.04036 4.07661 ] [ 2.81495 -0.0309523 2.80877 ] [ 4.27456 1.30079 3.98727 ] [ 2.73206 2.74248 -0.103972 ] [ 3.9224 4.04214 1.39211 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.47515e-12 -9.60157e-12 3.81768e-12 ] [ 1.54242e-10 1.27348e-10 1.38773e-10 ] [ -7.38039e-12 2.51333e-10 2.6891e-10 ] [ 1.45374e-10 4.04036e-10 4.07661e-10 ] [ 2.81495e-10 -3.09523e-12 2.80877e-10 ] [ 4.27456e-10 1.30079e-10 3.98727e-10 ] [ 2.73206e-10 2.74248e-10 -1.03972e-11 ] [ 3.9224e-10 4.04214e-10 1.39211e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0915707 0.088984 0.2445061 ] [ -0.0893713 0.2070273 -0.4075505 ] [ 0.857049 0.9572217 -0.8231019 ] [ -0.4219662 -0.2485244 -0.2527288 ] [ -0.3697353 0.0728756 0.2623727 ] [ -0.0630913 -0.3714631 1.1594219 ] [ -0.2887715 -0.4548943 -0.1069 ] [ 0.2843159 -0.2512268 -0.0760195 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.467124346902906e-10 1.425680844252672e-10 3.917419570629869e-10 ] [ -1.431886074305031e-10 3.316942999273478e-10 -6.529678828953504e-10 ] [ 1.373143870680019e-09 1.533638228662431e-09 -1.31875462071606e-09 ] [ -6.76064380407817e-10 -3.981799833783475e-10 -4.049161747628391e-10 ] [ -5.923812535444743e-10 1.167595825467725e-10 4.203674058761722e-10 ] [ -1.01083405835879e-10 -5.951494943098925e-10 1.857598661823515e-09 ] [ -4.626629460533473e-10 -7.288210123951814e-10 -1.7127268076352e-10 ] [ 4.555242879017108e-10 -4.025097054783974e-10 -1.217966656249056e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 154.29269 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.472041406783419e-17 } }