{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.31945e-10 0.0 0.0 ] "source-value" [ 5.31945 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.83334e-13 5.416950000000001e-10 0.0 ] "source-value" [ -0.00383334 5.41695 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.89848e-12 -1.18491e-11 5.47074e-10 ] "source-value" [ 0.0189848 -0.118491 5.47074 ] } "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" [ [ 2.360438750126016e-09 2.341430526696845e-09 -1.418853969671443e-10 ] [ -2.804038357874437e-09 6.971110531516321e-10 -1.211862363323808e-09 ] [ 8.398013996748325e-09 8.585550532607247e-09 -7.124673392784165e-09 ] [ -2.452574960840699e-09 -2.273422935673747e-09 -2.769165221328442e-10 ] [ -8.910989133918681e-10 9.338513943412953e-10 -1.621846543173562e-10 ] [ -7.50412313037705e-09 -6.41067684000826e-09 9.041135543002887e-09 ] [ 6.301392693138816e-10 -1.741125228021218e-09 2.46807297551136e-10 ] [ 2.263243506513494e-09 -2.132718663311457e-09 -3.704206712463667e-10 ] ] "source-value" [ [ 1.47327 1.461406 -0.0885579 ] [ -1.7501431 0.4351025 -0.756385 ] [ 5.2416281 5.3586792 -4.4468714 ] [ -1.5307769 -1.418959 -0.1728377 ] [ -0.5561802 0.5828642 -0.1012277 ] [ -4.6837053 -4.0012298 5.643033 ] [ 0.393302 -1.0867249 0.154045 ] [ 1.4126055 -1.3311383 -0.2311984 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.47515e-12 -9.60157e-12 3.81768e-12 ] [ 1.54242e-10 1.27348e-10 1.38773e-10 ] [ -7.38039e-12 2.51333e-10 2.6891e-10 ] [ 1.45374e-10 4.04036e-10 4.07661e-10 ] [ 2.81495e-10 -3.09523e-12 2.80877e-10 ] [ 4.27456e-10 1.30079e-10 3.98727e-10 ] [ 2.73206e-10 2.74248e-10 -1.03972e-11 ] [ 3.9224e-10 4.04214e-10 1.39211e-10 ] ] "source-value" [ [ -0.0147515 -0.0960157 0.0381768 ] [ 1.54242 1.27348 1.38773 ] [ -0.0738039 2.51333 2.6891 ] [ 1.45374 4.04036 4.07661 ] [ 2.81495 -0.0309523 2.80877 ] [ 4.27456 1.30079 3.98727 ] [ 2.73206 2.74248 -0.103972 ] [ 3.9224 4.04214 1.39211 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.620404343322295e-18 "source-value" -35.079805 } }