{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.44976 0 0 ] "si-unit" "m" "si-value" [ 5.449760000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0355309 5.38277 0 ] "si-unit" "m" "si-value" [ -3.55309e-12 5.38277e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.05055 0.148675 5.46244 ] "si-unit" "m" "si-value" [ 5.055e-12 1.48675e-11 5.46244e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0326933 -0.0289977 0.141129 ] [ 1.38935 1.3881 1.19735 ] [ 0.0127821 2.83796 2.59214 ] [ 1.40644 4.238 3.96398 ] [ 2.76811 0.0511022 2.83036 ] [ 4.1335 1.52222 4.23862 ] [ 2.69114 2.71897 0.000278438 ] [ 4.17588 4.12802 1.32379 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.26933e-12 -2.89977e-12 1.41129e-11 ] [ 1.38935e-10 1.3881e-10 1.19735e-10 ] [ 1.27821e-12 2.83796e-10 2.59214e-10 ] [ 1.40644e-10 4.238000000000001e-10 3.96398e-10 ] [ 2.76811e-10 5.11022e-12 2.830360000000001e-10 ] [ 4.1335e-10 1.52222e-10 4.23862e-10 ] [ 2.69114e-10 2.71897e-10 2.78438e-14 ] [ 4.17588e-10 4.12802e-10 1.32379e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.1254842 1.2749814 -4.1249481 ] [ 1.1676604 -1.1576852 4.7676466 ] [ 1.0772834 -1.5285852 1.7322337 ] [ -2.3809955 -2.4429935 2.9487517 ] [ 1.2654684 3.8599804 -4.2774983 ] [ 0.6132536 -0.7037638 -1.6224548 ] [ 0.8380923 1.8128135 -0.8593539 ] [ -3.7062467 -1.1147477 1.4356231 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.803224487176183e-09 2.042745407864607e-09 -6.608895462282694e-09 ] [ 1.870798209327093e-09 -1.854816176967617e-09 7.638611981689543e-09 ] [ 1.725998291676075e-09 -2.449063490518217e-09 2.775344358767366e-09 ] [ -3.814775355759147e-09 -3.914107102713879e-09 4.724421073207777e-09 ] [ 2.027503901545366e-09 6.184370404577973e-09 -6.853307828234722e-09 ] [ 9.825405886363822e-10 -1.127553916215049e-09 -2.599459170281143e-09 ] [ 1.342771900195318e-09 2.904447431499759e-09 -1.376836738916773e-09 ] [ -5.938061862579606e-09 -1.786022717745241e-09 2.300121786050645e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.339521 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.66201548029523e-18 } }