{ "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" [ [ 1.1033232 1.2495913 -3.874268 ] [ -0.0150207 -0.0683977 3.2178991 ] [ 1.0208439 -1.4564218 1.6888546 ] [ -2.2269966 -2.2833725 2.720699 ] [ 2.2439422 2.5880152 -2.698485 ] [ 0.5974693 -0.6902306 -1.5979274 ] [ 0.7963654 1.7394177 -0.7912768 ] [ -3.5199266 -1.0786015 1.3345045 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.767718636226243e-09 2.002065966415079e-09 -6.207261612313574e-09 ] [ -2.406581436805056e-11 -1.095851958564922e-10 5.155642706113361e-09 ] [ 1.635572230066293e-09 -2.333444957983454e-09 2.705843356050536e-09 ] [ -3.56804188712109e-09 -3.658366036077648e-09 4.35904033003394e-09 ] [ 3.595191731266518e-09 4.146457447715037e-09 -4.323449578579487e-09 ] [ 9.572513441057413e-10 -1.105871330280757e-09 -2.56016192201573e-09 ] [ 1.27591802549404e-09 2.786854372745708e-09 -1.267765189541437e-09 ] [ -5.639544105452032e-09 -1.728110106459811e-09 2.138111910252394e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.436116 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.677491658715681e-18 } }