{ "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" [ [ 1.2322881 1.0680602 -0.0860328 ] [ -1.3641584 0.2153825 -0.6050297 ] [ 3.3348502 3.1893518 -2.0420804 ] [ -1.263621 -1.1438891 -0.3011355 ] [ -0.3462439 0.3196821 -0.2177779 ] [ -2.8550824 -1.9928259 3.2462548 ] [ 0.3110745 -0.7798175 0.1765759 ] [ 0.9508929 -0.8759441 -0.1707743 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.974343183910053e-09 1.711221082046972e-09 -1.378397407819623e-10 ] [ -2.185622695547935e-09 3.45080806029456e-10 -9.693644402296377e-10 ] [ 5.343019024310204e-09 5.109904889466397e-09 -3.271773474673913e-09 ] [ -2.024544023751917e-09 -1.832712372807953e-09 -4.824722577929185e-10 ] [ -5.547438816746131e-10 5.121871867082477e-10 -3.489186599069203e-10 ] [ -4.574346271737554e-09 -3.192859066304719e-09 5.20107354571978e-09 ] [ 4.983962912270496e-10 -1.249405366990704e-09 2.829057787767187e-10 ] [ 1.523498373264712e-09 -1.403417158147697e-09 -2.736105908934854e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -25.493299 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.084476764486402e-18 } }