{ "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" [ [ 1.3693263 3.8693934 -6.9479 ] [ -0.0362969 -0.1557313 4.0953133 ] [ 1.2853431 -3.7658184 3.8820095 ] [ -2.6443958 -2.8175689 3.3279321 ] [ 2.6720209 3.2135727 -3.3583369 ] [ 0.4414726 -0.8684155 -1.6735092 ] [ 1.1131498 1.9754898 -1.2607602 ] [ -4.20062 -1.4509218 1.9352514 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.193902602181674e-09 6.199451693233815e-09 -1.11317630353686e-08 ] [ -5.81540450666346e-11 -2.495090500424441e-10 6.561415278169431e-09 ] [ 2.059346681493125e-09 -6.033506248367265e-09 6.219664913866022e-09 ] [ -4.236789161807737e-09 -4.514243056265082e-09 5.331935050158551e-09 ] [ 4.281049451539651e-09 5.148711091600291e-09 -5.380648910279993e-09 ] [ 7.073170842712284e-10 -1.391355022703427e-09 -2.681257337024033e-09 ] [ 1.783462599701773e-09 3.165083598265333e-09 -2.019960533517166e-09 ] [ -6.730135212313079e-09 -2.324633005721221e-09 3.100614573995787e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.033353 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.612961958727379e-18 } }