{ "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" [ [ 1.3109921 0.9951878 -0.1010118 ] [ -1.3391928 0.2215143 -0.7833462 ] [ 3.8042405 3.7586544 -2.9074439 ] [ -1.3631073 -1.0427282 -0.2335296 ] [ -0.5073915 0.4113583 -0.001604 ] [ -2.8584489 -2.5435016 4.1861245 ] [ 0.1017406 -0.8582196 0.127802 ] [ 0.8511674 -0.9422653 -0.286991 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.100440909978591e-09 1.594466639601865e-09 -1.618387457182812e-10 ] [ -2.145623412581035e-09 3.549050355568661e-10 -1.255058977972691e-09 ] [ 6.095065239216477e-09 6.02202825496129e-09 -4.658238681245832e-09 ] [ -2.183938665694828e-09 -1.670634757652879e-09 -3.741556684673664e-10 ] [ -8.129308055902109e-10 6.590686564619621e-10 -2.569891320935999e-12 ] [ -4.579740037063002e-09 -4.075138832061614e-09 6.706910860914933e-09 ] [ 1.630064120491404e-10 -1.375019389960826e-09 2.04761378178468e-10 ] [ 1.363720519902531e-09 -1.509675446689e-09 -4.59810274368294e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -25.372662074190156 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.065148631764544e-18 } }