{ "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" [ [ 2.7709146 3.1566474 -1.5539117 ] [ -5.0543328 4.1308466 -5.86943 ] [ 0.0930574 -0.4758008 0.2775653 ] [ -1.0258578 -2.4210428 3.3567335 ] [ 5.4196038 -2.0029365 0.5015032 ] [ -1.671598 1.7285235 2.681392 ] [ -0.4934283 -4.3984286 -4.3405303 ] [ -0.0383589 0.2821912 4.9466779 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.439494590353383e-09 5.057506664389107e-09 -2.489640996527583e-09 ] [ -8.097933845902603e-09 6.618345846631169e-09 -9.403863523422146e-09 ] [ 1.490943906724339e-10 -7.623169179179367e-10 4.447086344053383e-10 ] [ -1.643605383425322e-09 -3.878938172116171e-09 5.378079935956157e-09 ] [ 8.68316250235884e-09 -3.209058033246979e-09 8.034967022963866e-10 ] [ -2.678195234976039e-09 2.769399940203389e-09 4.296063573600154e-09 ] [ -7.905592863010886e-10 -7.047059471178075e-09 -6.954296168534011e-09 ] [ -6.145773277960512e-11 4.521201432354969e-10 7.92545168200804e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -27.270707 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.369248918808691e-18 } }