{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.46441e-10 0.0 0.0 ] "source-value" [ 5.46441 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.39301e-11 5.60761e-10 0.0 ] "source-value" [ 0.239301 5.60761 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.67861e-11 -7.33416e-11 5.71653e-10 ] "source-value" [ 0.167861 -0.733416 5.71653 ] } "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" [ [ -5.000754364127129e-09 -3.756630732584554e-09 -2.192574219470262e-09 ] [ 7.452383560108569e-09 -3.401325476231801e-09 -1.848717957032083e-09 ] [ -2.788497565088001e-09 8.930381879736845e-09 3.821821697108285e-09 ] [ -1.461514966335823e-09 -3.070112630379003e-09 -2.634533358576646e-09 ] [ -6.259052772669245e-09 1.336909012180474e-08 9.796768019841183e-09 ] [ -7.781793797045306e-09 -2.167209840951053e-09 4.314325663377019e-09 ] [ 7.114083485973663e-09 -4.66992347718073e-10 -5.066459467128474e-09 ] [ 8.725146419183269e-09 -9.437200973677103e-09 -6.190630378119022e-09 ] ] "source-value" [ [ -3.1212254 -2.3447045 -1.3684972 ] [ 4.651412 -2.1229404 -1.153879 ] [ -1.7404433 5.573906 2.3853935 ] [ -0.9122059 -1.9162136 -1.6443464 ] [ -3.9065935 8.3443298 6.1146617 ] [ -4.8570137 -1.352666 2.6927903 ] [ 4.4402617 -0.29147370000000006 -3.1622353 ] [ 5.4458081 -5.8902376 -3.8638876 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 3.27702e-13 -3.82766e-12 4.33443e-11 ] [ 1.09616e-10 1.45225e-10 1.46895e-10 ] [ 1.30178e-11 2.57242e-10 2.88603e-10 ] [ 1.56489e-10 3.87283e-10 4.500250000000001e-10 ] [ 2.74098e-10 -2.14768e-11 2.33093e-10 ] [ 4.21449e-10 1.24218e-10 3.87733e-10 ] [ 2.20243e-10 2.94328e-10 2.28142e-11 ] [ 4.00805e-10 4.02926e-10 1.38377e-10 ] ] "source-value" [ [ 0.00327702 -0.0382766 0.433443 ] [ 1.09616 1.45225 1.46895 ] [ 0.130178 2.57242 2.88603 ] [ 1.56489 3.87283 4.50025 ] [ 2.74098 -0.214768 2.33093 ] [ 4.21449 1.24218 3.87733 ] [ 2.20243 2.94328 0.228142 ] [ 4.00805 4.02926 1.38377 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.293376402971748e-18 "source-value" -26.797148 } }