{ "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" [ 5.47373 0 0 ] "si-unit" "m" "si-value" [ 5.47373e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.128217 5.8305 0 ] "si-unit" "m" "si-value" [ -1.28217e-11 5.8305e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.28854 -0.0943746 5.99929 ] "si-unit" "m" "si-value" [ 2.8854e-11 -9.437460000000001e-12 5.99929e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.153552 -0.151682 0.285368 ] [ 1.56659 1.11428 1.80298 ] [ 0.0114317 2.78427 2.63644 ] [ 1.58247 4.14354 3.67768 ] [ 2.87662 -0.0580046 2.88139 ] [ 4.22527 1.43863 4.17233 ] [ 2.56962 2.98931 0.105287 ] [ 4.06718 4.1162 1.17836 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.53552e-11 -1.51682e-11 2.85368e-11 ] [ 1.56659e-10 1.11428e-10 1.80298e-10 ] [ 1.14317e-12 2.78427e-10 2.63644e-10 ] [ 1.58247e-10 4.14354e-10 3.67768e-10 ] [ 2.87662e-10 -5.800460000000001e-12 2.88139e-10 ] [ 4.22527e-10 1.43863e-10 4.17233e-10 ] [ 2.56962e-10 2.98931e-10 1.05287e-11 ] [ 4.067179999999999e-10 4.1162e-10 1.17836e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 6.5601533 7.3165114 -6.7476007 ] [ -9.2753026 7.7065055 -10.7371483 ] [ -1.4468553 -1.0747361 -1.3260831 ] [ -2.7050307 -4.4468773 8.9280071 ] [ 12.9516542 -2.9595095 -0.0525382 ] [ -0.4323719 0.1790499 3.0988194 ] [ -5.110106 -5.3109596 -5.7063016 ] [ -0.542141 -1.4099843 12.5428454 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.051052424612397e-08 1.172234351089668e-08 -1.081084808803371e-08 ] [ -1.486067297656546e-08 1.234718294016661e-08 -1.720280798032247e-08 ] [ -2.31811773534057e-09 -1.721917052949771e-09 -2.124619340057988e-09 ] [ -4.333936946086259e-09 -7.124682845626228e-09 1.430424424595641e-08 ] [ 2.075083755992613e-08 -4.741656929935498e-09 -8.417547573891457e-11 ] [ -6.927361496708755e-10 2.86869563736578e-10 4.964855994761484e-09 ] [ -8.187292363009806e-09 -8.50909530513332e-09 -9.142503014753633e-09 ] [ -8.686056353771329e-10 -2.259043881155054e-09 2.009585365818882e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -25.520643 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.088857756238318e-18 } }