{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.449760000000001e-10 0.0 0.0 ] "source-value" [ 5.44976 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.55309e-12 5.38277e-10 0.0 ] "source-value" [ -0.0355309 5.38277 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.055e-12 1.48675e-11 5.46244e-10 ] "source-value" [ 0.05055 0.148675 5.46244 ] } "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" [ [ 1.799276548908478e-09 2.045814200134333e-09 -6.612543563998943e-09 ] [ 1.064167313711981e-10 -1.412285045526163e-10 5.547330990259552e-09 ] [ 1.722867624338892e-09 -2.445936502230077e-09 2.772359000204344e-09 ] [ -3.810964547237434e-09 -3.918201272603157e-09 4.729185747336852e-09 ] [ 3.792663364351022e-09 4.471712599803389e-09 -4.761953944238441e-09 ] [ 9.842803841339617e-10 -1.12979791550046e-09 -2.597170759997251e-09 ] [ 1.339677124771763e-09 2.907216769859674e-09 -1.379966419384372e-09 ] [ -5.934217390855542e-09 -1.789579535128748e-09 2.302759110035919e-09 ] ] "source-value" [ [ 1.1230201 1.2768968 -4.1272251 ] [ 0.0664201 -0.0881479 3.4623717 ] [ 1.0753294 -1.5266335 1.7303704 ] [ -2.378617 -2.4455489 2.9517256 ] [ 2.3671943 2.7910235 -2.9721779 ] [ 0.6143395 -0.7051644 -1.6210265 ] [ 0.8361607 1.814542 -0.8613073 ] [ -3.7038472 -1.1169677 1.4372692 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.666383928421338e-18 "source-value" -35.366787 } }