{ "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" [ [ 3.0956252 2.0252883 -0.3097467 ] [ -2.9499016 0.3006361 -0.9074833 ] [ 5.9825174 5.0337469 -2.7798793 ] [ -2.2782392 -2.2818569 0.0953286 ] [ -0.7332484 0.3400035 -1.4065649 ] [ -5.4117145 -3.0739527 5.0080011 ] [ 0.4994548 -0.7141696 0.8254306 ] [ 1.7955063 -1.6296956 -0.5250861 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.959738322199324e-09 3.244869564639777e-09 -4.962689211099514e-10 ] [ -4.726263377180513e-09 4.816721307884909e-10 -1.453948527026433e-09 ] [ 9.585049511809201e-09 8.064951598204475e-09 -4.45385762310587e-09 ] [ -3.650141582830095e-09 -3.655937777191164e-09 1.527332542135949e-10 ] [ -1.174793443719007e-09 5.447456586901728e-10 -2.25356539841789e-09 ] [ -8.670522450344363e-09 -4.925015149385036e-09 8.023702279360683e-09 ] [ 8.002148037063397e-10 -1.144225836406088e-09 1.322485609412917e-09 ] [ 2.876718216359111e-09 -2.611060189340628e-09 -8.412806733270509e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -34.45941 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.521006106856173e-18 } }