{ "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" [ 5.50751 0 0 ] "si-unit" "m" "si-value" [ 5.50751e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0552432 5.46365 0 ] "si-unit" "m" "si-value" [ 5.52432e-12 5.46365e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.041151 -0.173599 5.4807 ] "si-unit" "m" "si-value" [ -4.115100000000001e-12 -1.73599e-11 5.4807e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0203681 -0.0104771 -0.043973 ] [ 1.36957 1.30557 1.36025 ] [ 0.0138031 2.57027 2.84477 ] [ 1.29725 4.08516 4.13225 ] [ 2.77149 -0.00701058 2.61036 ] [ 3.98017 1.30013 4.07827 ] [ 2.6961 2.74296 0.249943 ] [ 4.17055 4.00651 1.44609 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.03681e-12 -1.04771e-12 -4.3973e-12 ] [ 1.36957e-10 1.30557e-10 1.36025e-10 ] [ 1.38031e-12 2.57027e-10 2.84477e-10 ] [ 1.29725e-10 4.08516e-10 4.13225e-10 ] [ 2.77149e-10 -7.01058e-13 2.61036e-10 ] [ 3.98017e-10 1.30013e-10 4.07827e-10 ] [ 2.6961e-10 2.74296e-10 2.49943e-11 ] [ 4.170550000000001e-10 4.00651e-10 1.44609e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3887186 0.0933372 0.0696008 ] [ -0.2268742 -0.0352154 -0.0324277 ] [ 0.0418262 -0.0064195 0.1007891 ] [ 0.4032691 -0.1221608 -0.1733067 ] [ -0.0588596 -0.1924608 0.1744452 ] [ -0.0642701 0.0680291 0.2524459 ] [ -0.0238374 0.1666639 -0.320022 ] [ 0.3174648 0.0282263 -0.0715247 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.227958529901069e-10 1.495426796909337e-10 1.115127745489767e-10 ] [ -3.634925391027034e-10 -5.642129057212032e-11 -5.195490280631616e-11 ] [ 6.701295977690497e-11 -1.02851728172256e-11 1.614819396514733e-10 ] [ 6.461083239110573e-10 -1.957231777382246e-10 -2.776679429679994e-10 ] [ -9.430347502963969e-11 -3.083561941804646e-10 2.794920210507801e-10 ] [ -1.029720516364781e-10 1.089946335540653e-10 4.044629189968147e-10 ] [ -3.819172498065793e-11 2.670250041113492e-10 -5.127317665416575e-10 ] [ 5.086346804869478e-10 4.522351795168704e-11 -1.145952021497338e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 29.377867 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.706853167637183e-18 } }