{ "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" [ 5.41394 0 0 ] "si-unit" "m" "si-value" [ 5.413940000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0321649 5.43167 0 ] "si-unit" "m" "si-value" [ 3.216490000000001e-12 5.431670000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.034689 -0.0250046 5.52467 ] "si-unit" "m" "si-value" [ -3.4689e-12 -2.50046e-12 5.52467e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0104706 0.0216981 0.0176006 ] [ 1.39448 1.38403 1.49781 ] [ 0.0179868 2.6904 2.7801 ] [ 1.33759 4.02716 4.17727 ] [ 2.6683 -0.0231463 2.83015 ] [ 4.02805 1.42643 4.22871 ] [ 2.71964 2.8128 -0.0574889 ] [ 4.09713 4.0529 1.34951 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.04706e-12 2.16981e-12 1.76006e-12 ] [ 1.39448e-10 1.38403e-10 1.49781e-10 ] [ 1.79868e-12 2.6904e-10 2.7801e-10 ] [ 1.33759e-10 4.02716e-10 4.17727e-10 ] [ 2.6683e-10 -2.31463e-12 2.83015e-10 ] [ 4.02805e-10 1.42643e-10 4.228710000000001e-10 ] [ 2.71964e-10 2.8128e-10 -5.74889e-12 ] [ 4.09713e-10 4.052900000000001e-10 1.34951e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5575644 0.3615392 0.4483356 ] [ 0.1773595 -0.1767131 -1.7007717 ] [ -0.7848731 0.3202374 0.3207867 ] [ -0.8605197 1.1636065 -0.7613363 ] [ 0.9508039 -0.2251879 0.1521971 ] [ 0.3212142 -0.904204 -1.0815485 ] [ -0.216452 -1.0386498 1.8641319 ] [ -0.1450971 0.4993718 0.7582052 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.933166536302294e-10 5.792496585150527e-10 7.183128225103703e-10 ] [ 2.84161246717923e-10 -2.831255997417054e-10 -2.724936677508458e-09 ] [ -1.257505341475145e-09 5.130768796129115e-10 5.139569552379677e-10 ] [ -1.37870455643669e-09 1.864303145470521e-09 -1.219795230476014e-09 ] [ 1.523355792096072e-09 -3.607907916395286e-10 2.438466373825613e-10 ] [ 5.146418857490028e-10 -1.448694521169336e-09 -1.732831735237749e-09 ] [ -3.46794336782568e-10 -1.664100440468773e-09 2.986668572874025e-09 ] [ -2.324711832811614e-10 8.00081829638521e-10 1.214778655217297e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.672943 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.875653237461385e-18 } }