{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.31945e-10 0.0 0.0 ] "source-value" [ 5.31945 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.83334e-13 5.416950000000001e-10 0.0 ] "source-value" [ -0.00383334 5.41695 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.89848e-12 -1.18491e-11 5.47074e-10 ] "source-value" [ 0.0189848 -0.118491 5.47074 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 2.192941919004735e-09 1.706670259573252e-09 -1.283139996829959e-10 ] [ -2.226874257438997e-09 2.959269886092845e-10 -9.230652208947456e-10 ] [ 5.267763827125256e-09 4.789125738203574e-09 -2.980054763176821e-09 ] [ -2.028053110986793e-09 -1.893395453191402e-09 -3.703524185223206e-10 ] [ -5.574324942619776e-10 5.119758596119642e-10 -4.951621375003027e-10 ] [ -4.561107806755208e-09 -2.934888923583483e-09 4.884041885573007e-09 ] [ 4.520916244916467e-10 -1.090005135422636e-09 3.191183349777024e-10 ] [ 1.460669978386013e-09 -1.385409333800554e-09 -3.062115205558617e-10 ] ] "source-value" [ [ 1.3687267 1.0652198 -0.0800873 ] [ -1.3899056 0.1847031 -0.576132 ] [ 3.2878796 2.9891372 -1.8600039 ] [ -1.2658112 -1.1817645 -0.2311558 ] [ -0.347922 0.3195502 -0.3090559 ] [ -2.8468196 -1.8318136 3.0483792 ] [ 0.2821734 -0.6803277 0.199178 ] [ 0.9116785 -0.8647045 -0.1911222 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.635140082694221e-18 "source-value" -22.68876 } }