{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.48581e-10 0.0 0.0 ] "source-value" [ 5.48581 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.28581e-13 5.44331e-10 0.0 ] "source-value" [ 0.00228581 5.44331 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.06328e-12 -9.57916e-12 5.427310000000001e-10 ] "source-value" [ -0.0206328 -0.0957916 5.42731 ] } "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" [ [ 1.051150910409278e-09 1.75112361122332e-09 -7.288732433530196e-10 ] [ -9.270548008981997e-10 1.988570832738081e-09 -2.651503292908835e-09 ] [ 6.949961800121761e-10 -3.248222439654125e-10 2.418686201610524e-09 ] [ -1.942674400605658e-10 -1.298752567129006e-09 -1.267748046251595e-09 ] [ 2.088637337072738e-09 1.68547057896215e-09 6.827016213642079e-09 ] [ -3.268982803435803e-09 9.098845944884103e-10 -1.668075266737139e-09 ] [ -8.432806704027955e-10 -1.835912880825663e-09 -2.440887883480274e-09 ] [ 1.398801447520835e-09 -2.875562245927204e-09 -4.886148427394035e-10 ] ] "source-value" [ [ 0.6560768 1.0929654 -0.4549269 ] [ -0.5786221 1.2411683 -1.6549382 ] [ 0.4337825 -0.2027381 1.5096252 ] [ -0.1212522 -0.8106176 -0.7912661 ] [ 1.3036249 1.051988 4.2610884 ] [ -2.0403386 0.5679053 -1.0411307 ] [ -0.5263344 -1.1458867 -1.5234824 ] [ 0.8730632 -1.7947848 -0.3049694 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -5.845640000000001e-13 1.26862e-13 1.77865e-12 ] [ 1.36937e-10 1.35462e-10 1.37323e-10 ] [ -3.02415e-12 2.74811e-10 2.64947e-10 ] [ 1.37836e-10 4.07615e-10 4.081070000000001e-10 ] [ 2.65918e-10 -4.13914e-12 2.54007e-10 ] [ 4.19104e-10 1.29728e-10 4.08084e-10 ] [ 2.79028e-10 2.80414e-10 6.05432e-12 ] [ 4.08315e-10 4.18517e-10 1.33386e-10 ] ] "source-value" [ [ -0.00584564 0.00126862 0.0177865 ] [ 1.36937 1.35462 1.37323 ] [ -0.0302415 2.74811 2.64947 ] [ 1.37836 4.07615 4.08107 ] [ 2.65918 -0.0413914 2.54007 ] [ 4.19104 1.29728 4.08084 ] [ 2.79028 2.80414 0.0605432 ] [ 4.08315 4.18517 1.33386 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.419405999060086e-18 "source-value" -33.825272 } }