{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.412740000000001e-10 0.0 0.0 ] "source-value" [ 5.41274 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.62551e-13 5.52562e-10 0.0 ] "source-value" [ 0.00162551 5.52562 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 4.47781e-12 -2.07227e-12 5.37358e-10 ] "source-value" [ 0.0447781 -0.0207227 5.37358 ] } "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" [ [ 1.180077422214405e-09 -1.959964770262007e-09 7.510298079291275e-09 ] [ -1.427531838902682e-09 -6.654103865324832e-10 3.879447984716909e-10 ] [ -4.433781869394259e-09 -5.39400252743133e-09 -2.608821788383709e-09 ] [ 3.909481906997439e-09 3.719205809334611e-09 -6.651546791438035e-10 ] [ -4.755306673656403e-10 -5.088179694923674e-10 -8.657409435791424e-11 ] [ -5.800456150879488e-11 1.866267558865678e-09 -6.921918742510235e-09 ] [ 1.7054168768028e-09 1.533576865297855e-09 3.395017867093372e-09 ] [ -4.001272688432679e-10 1.409145420220043e-09 -1.010791280243015e-09 ] ] "source-value" [ [ 0.7365464 -1.2233138 4.6875594 ] [ -0.8909953 -0.4153165 0.2421361 ] [ -2.767349 -3.3666716 -1.6282985 ] [ 2.4401067 2.3213457 -0.4151569 ] [ -0.2968029 -0.3175792 -0.0540353 ] [ -0.0362036 1.1648326 -4.3203219 ] [ 1.0644375 0.9571834 2.1190035 ] [ -0.2497398 0.8795194 -0.6308863 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -3.91133e-12 1.8955e-12 -1.94937e-11 ] [ 1.34586e-10 1.33293e-10 1.3663e-10 ] [ 9.13327e-12 2.8499e-10 2.77756e-10 ] [ 1.30939e-10 4.04312e-10 4.06983e-10 ] [ 2.74681e-10 -3.01059e-12 2.75341e-10 ] [ 4.03842e-10 1.37613e-10 4.21696e-10 ] [ 2.56627e-10 2.70409e-10 -1.78064e-12 ] [ 4.07687e-10 4.07853e-10 1.33472e-10 ] ] "source-value" [ [ -0.0391133 0.018955 -0.194937 ] [ 1.34586 1.33293 1.3663 ] [ 0.0913327 2.8499 2.77756 ] [ 1.30939 4.04312 4.06983 ] [ 2.74681 -0.0301059 2.75341 ] [ 4.03842 1.37613 4.21696 ] [ 2.56627 2.70409 -0.0178064 ] [ 4.07687 4.07853 1.33472 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.688120658635731e-18 "source-value" -35.502457 } }