{ "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" [ [ -3.831211 -1.5030494 -0.3578943 ] [ 2.2631458 1.1418288 3.8676295 ] [ 0.3495527 0.6650514 -1.2331013 ] [ 1.4776066 -0.2363159 -2.7482469 ] [ -1.6987613 -1.0487834 -1.7992605 ] [ 0.0028106 0.9360566 2.6130673 ] [ 0.2789223 -1.2999921 -1.6213414 ] [ 1.1579344 1.3452039 1.2791476 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.138276693551789e-09 -2.408150608587468e-09 -5.734098801775815e-10 ] [ 3.625959290221713e-09 1.829411408316119e-09 6.196625562816393e-09 ] [ 5.600451636775162e-10 1.065529804710309e-09 -1.975646073938087e-09 ] [ 2.367386749259777e-09 -3.786198101033107e-10 -4.403176931366075e-09 ] [ -2.721715639179815e-09 -1.680336243763135e-09 -2.882733107828919e-09 ] [ 4.50307761042048e-12 1.499728000265537e-09 4.18659533663698e-09 ] [ 4.468827880797639e-10 -2.082816949844696e-09 -2.597675285415141e-09 ] [ 1.855215424100076e-09 2.155254238788981e-09 2.04942037927243e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.675675 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.715873241625904e-18 } }