{ "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" [ [ 2.1696117 1.5716257 -0.4223804 ] [ -2.1118229 0.3682044 -0.756078 ] [ 5.1303395 4.6358397 -4.3419604 ] [ -1.2056712 -1.0732892 0.5059945 ] [ -0.6270514 0.4871465 -0.4823027 ] [ -5.1103829 -3.796978 5.4581789 ] [ 0.3348372 -0.7873557 0.4449575 ] [ 1.42014 -1.4051934 -0.4064094 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.476101141954143e-09 2.518021953188434e-09 -6.767280019641523e-10 ] [ -3.383513277650056e-09 5.899284813556915e-10 -1.211370495101222e-09 ] [ 8.219710003666761e-09 7.427433985116486e-09 -6.956587441319416e-09 ] [ -1.931698209011881e-09 -1.719598863597136e-09 8.106925581533856e-10 ] [ -1.004647093119909e-09 7.804947332045472e-10 -7.727341100887161e-10 ] [ -8.187736005716105e-09 -6.083429381291942e-09 8.744966625723862e-09 ] [ 5.364683336141338e-10 -1.261482894793618e-09 7.129005037496161e-10 ] [ 2.275315106262912e-09 -2.251368013182463e-09 -6.511396391533556e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.916641 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.754480250786674e-18 } }