{ "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" [ [ 0.8876737 1.0140664 -3.257474 ] [ 0.0258456 -0.0521243 2.8788035 ] [ 0.9225835 -0.9699046 1.2686859 ] [ -1.8449027 -2.0277754 2.1465734 ] [ 1.8949069 2.2395597 -2.1711836 ] [ 0.2966353 -0.6149589 -1.1957102 ] [ 0.7487402 1.3148366 -0.9608867 ] [ -2.9314824 -0.9036995 1.2911917 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.422210049039033e-09 1.624713478018821e-09 -5.21904868566386e-09 ] [ 4.140921607054848e-11 -8.351233483556544e-11 4.612351663577213e-09 ] [ 1.478141714435837e-09 -1.553958474526376e-09 2.032658888118607e-09 ] [ -2.955859973590796e-09 -3.248854338113368e-09 3.439189716311167e-09 ] [ 3.035975533772604e-09 3.588170192225862e-09 -3.478619603384379e-09 ] [ 4.752621425639943e-10 -9.85272772332885e-10 -1.915738927692092e-09 ] [ 1.199614043493116e-09 2.106600460692161e-09 -1.539510205977663e-09 ] [ -4.696752565566674e-09 -1.447886211128649e-09 2.068717154711008e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.707348 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.720947815636965e-18 } }