{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.413940000000001e-10 0.0 0.0 ] "source-value" [ 5.41394 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 3.216490000000001e-12 5.431670000000001e-10 0.0 ] "source-value" [ 0.0321649 5.43167 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.4689e-12 -2.50046e-12 5.52467e-10 ] "source-value" [ -0.034689 -0.0250046 5.52467 ] } "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" [ [ -8.499242239350724e-09 -4.489892978572593e-09 -3.103413711224669e-09 ] [ -1.578317166780708e-09 -5.821287651303129e-09 1.434743828678253e-08 ] [ 9.702916198400948e-10 -1.135815050017536e-11 -1.415357699849533e-09 ] [ -3.317379752620309e-09 5.470579840763762e-09 -4.439376029283445e-09 ] [ -8.912224091657994e-09 3.996880801879742e-09 -2.447971106320831e-09 ] [ 5.294414112600318e-09 -2.059989618004524e-09 3.180428899427566e-09 ] [ 1.141381155794091e-08 3.551126266576345e-09 -3.9581773416864e-10 ] [ 4.628645960028411e-09 -6.360585108394271e-10 -5.725930905362976e-09 ] ] "source-value" [ [ -5.3048098 -2.8023708 -1.9369985 ] [ -0.9851081 -3.633362 8.9549667 ] [ 0.6056084 -0.0070892 -0.8833968 ] [ -2.0705456 3.4144674 -2.7708406 ] [ -5.5625728 2.4946568 -1.5279034 ] [ 3.3045134 -1.2857444 1.9850676 ] [ 7.1239409 2.2164387 -0.24705 ] [ 2.8889736 -0.3969965 -3.573845 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.538247350196428e-18 "source-value" -15.842494 } }