{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.366440000000001e-10 0.0 0.0 ] "source-value" [ 5.36644 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.27231e-11 5.379480000000001e-10 0.0 ] "source-value" [ -0.227231 5.37948 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.50261e-12 -8.992650000000001e-12 5.399390000000001e-10 ] "source-value" [ -0.0350261 -0.0899265 5.39939 ] } "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" [ [ -1.145314355202259e-10 3.711409297462473e-09 -1.307612123189044e-09 ] [ -1.687860385609736e-09 1.460021737725237e-09 -4.388618112630528e-10 ] [ 3.08145475911297e-09 3.196870435910216e-09 -3.194551605686932e-09 ] [ -6.346973015823956e-10 1.803784593266423e-09 -4.999804914261643e-09 ] [ 3.323193090271219e-10 -2.209627466986733e-09 2.528127361788806e-09 ] [ -2.958428262713939e-09 -2.791310666798801e-09 4.458532293832378e-09 ] [ 4.791650768557955e-09 -2.437779340400598e-09 2.096536708683931e-09 ] [ -2.809907451271751e-09 -2.73336875039588e-09 8.576340900955564e-10 ] ] "source-value" [ [ -0.0714849 2.3164795 -0.8161473 ] [ -1.0534796 0.9112739 -0.273916 ] [ 1.9232928 1.9953296 -1.9938823 ] [ -0.3961469 1.1258338 -3.1206328 ] [ 0.2074174 -1.379141 1.577933 ] [ -1.8465057 -1.7421991 2.782797 ] [ 2.9907132 -1.5215422 1.3085553 ] [ -1.7538063 -1.7060346 0.5352931 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.04229e-13 7.7963e-13 2.24549e-13 ] [ 1.32493e-10 1.37357e-10 1.36608e-10 ] [ -9.58533e-12 2.66355e-10 2.80902e-10 ] [ 1.19786e-10 4.07015e-10 4.22336e-10 ] [ 2.70129e-10 1.13781e-11 2.60003e-10 ] [ 3.9906e-10 1.45175e-10 3.98519e-10 ] [ 2.48193e-10 2.86985e-10 1.62227e-13 ] [ 4.00824e-10 4.16333e-10 1.43322e-10 ] ] "source-value" [ [ -0.00104229 0.0077963 0.00224549 ] [ 1.32493 1.37357 1.36608 ] [ -0.0958533 2.66355 2.80902 ] [ 1.19786 4.07015 4.22336 ] [ 2.70129 0.113781 2.60003 ] [ 3.9906 1.45175 3.98519 ] [ 2.48193 2.86985 0.00162227 ] [ 4.00824 4.16333 1.43322 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.691943291835298e-18 "source-value" -35.526316 } }