{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.46497e-10 0.0 0.0 ] "source-value" [ 5.46497 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.64453e-13 5.45437e-10 0.0 ] "source-value" [ 0.00264453 5.45437 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -4.343610000000001e-13 1.34648e-11 5.521480000000001e-10 ] "source-value" [ -0.00434361 0.134648 5.52148 ] } "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" [ [ 9.49037144788562e-10 -1.02905337001988e-09 -3.022423202390242e-09 ] [ -4.065693006001805e-10 1.222588935800064e-11 8.097921348924959e-10 ] [ 2.031431781044736e-11 -6.165044258355495e-10 -1.336536858594995e-09 ] [ -2.04345307244826e-09 -1.437476228752664e-09 6.608421804424272e-09 ] [ 2.400233613033446e-09 1.276254963237395e-09 -3.239855873340307e-09 ] [ -1.399782139830426e-09 1.065571941955436e-09 3.748728477055444e-09 ] [ 7.34770374841198e-10 -4.374629508554323e-10 -4.568171483040992e-09 ] [ -2.545509375947866e-10 1.166444180912694e-09 1.000044840776661e-09 ] ] "source-value" [ [ 0.5923424 -0.6422846 -1.8864482 ] [ -0.2537606 0.0076308 0.5054325 ] [ 0.0126792 -0.3847918 -0.8342007 ] [ -1.2754231 -0.8972021 4.1246525 ] [ 1.498108 0.7965757 -2.022159 ] [ -0.8736753 0.6650777 2.3397723 ] [ 0.4586076 -0.2730429 -2.8512284 ] [ -0.1588782 0.7280372 0.6241789 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 6.017079999999999e-14 -1.29581e-13 -1.03934e-13 ] [ 1.36071e-10 1.38338e-10 1.29931e-10 ] [ 3.79757e-12 2.812460000000001e-10 2.65752e-10 ] [ 1.43056e-10 4.2109e-10 3.80234e-10 ] [ 2.71672e-10 5.9655e-12 2.71923e-10 ] [ 4.18219e-10 1.40754e-10 3.91392e-10 ] [ 2.71688e-10 2.7266e-10 3.75018e-12 ] [ 4.08381e-10 4.07468e-10 1.29537e-10 ] ] "source-value" [ [ 0.000601708 -0.00129581 -0.00103934 ] [ 1.36071 1.38338 1.29931 ] [ 0.0379757 2.81246 2.65752 ] [ 1.43056 4.2109 3.80234 ] [ 2.71672 0.059655 2.71923 ] [ 4.18219 1.40754 3.91392 ] [ 2.71688 2.7266 0.0375018 ] [ 4.08381 4.07468 1.29537 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -6.562816167348525e-18 "source-value" -40.961877 } }