{ "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" [ 5.42981 0 0 ] "si-unit" "m" "si-value" [ 5.42981e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0370196 5.47054 0 ] "si-unit" "m" "si-value" [ 3.70196e-12 5.47054e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0339139 -0.0143321 5.52419 ] "si-unit" "m" "si-value" [ -3.39139e-12 -1.43321e-12 5.52419e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0865271 0.0202603 -0.0485063 ] [ 1.27669 1.31148 1.22292 ] [ -0.0137625 2.6467 2.79128 ] [ 1.29807 4.01993 4.311 ] [ 2.70854 -0.0697941 2.82717 ] [ 4.06866 1.27154 4.01384 ] [ 2.71531 2.7055 0.0603487 ] [ 4.06455 4.01651 1.33765 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.65271e-12 2.02603e-12 -4.850630000000001e-12 ] [ 1.27669e-10 1.31148e-10 1.22292e-10 ] [ -1.37625e-12 2.6467e-10 2.79128e-10 ] [ 1.29807e-10 4.019929999999999e-10 4.311e-10 ] [ 2.70854e-10 -6.97941e-12 2.82717e-10 ] [ 4.06866e-10 1.27154e-10 4.01384e-10 ] [ 2.71531e-10 2.7055e-10 6.03487e-12 ] [ 4.06455e-10 4.016510000000001e-10 1.33765e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.4023651 0.8112362 0.3090982 ] [ -1.5496367 -0.9501274 -2.1270353 ] [ -0.0500616 -0.4353052 0.6783196 ] [ -1.1335866 -0.0402631 1.9794156 ] [ 1.3957504 1.1016109 0.8692161 ] [ -0.1666241 -0.724729 -1.5034739 ] [ -0.1130328 1.1292725 0.7471811 ] [ -0.7851738 -0.8916948 -0.9527214 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.849013229557073e-09 1.299743684294951e-09 4.952299136514587e-10 ] [ -2.482791711928867e-09 -1.522271919603171e-09 -3.40788625735318e-09 ] [ -8.020752578065438e-11 -6.974358200986967e-10 1.086787813504226e-09 ] [ -1.816205963135504e-09 -6.45085980324054e-11 3.17137342329509e-09 ] [ 2.236238677776153e-09 1.764975243739711e-09 1.392637725316607e-09 ] [ -2.669612396812794e-10 -1.161143869782186e-09 -2.408830752408853e-09 ] [ -1.810985110355952e-10 1.809294012918765e-09 1.197116099786417e-09 ] [ -1.257987115988989e-09 -1.428652573219303e-09 -1.526427965791768e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.4493096015624758 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.198733450552485e-20 } }