{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.999551 1.685791 2.486539 ] [ 2.806467 1.943327 4.558328 ] [ 1.52714 3.922099 3.002179 ] [ 4.336396 2.072479 2.061694 ] [ 5.046676 1.88237 4.081611 ] [ 3.556935 4.352885 1.849563 ] [ 3.300335 4.140991 4.307093 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.999551e-10 1.685791e-10 2.486539e-10 ] [ 2.806467e-10 1.943327e-10 4.558328e-10 ] [ 1.52714e-10 3.922099e-10 3.002179e-10 ] [ 4.336396e-10 2.072479e-10 2.061694e-10 ] [ 5.046676e-10 1.88237e-10 4.081611e-10 ] [ 3.556935e-10 4.352885e-10 1.849563e-10 ] [ 3.300335e-10 4.140991e-10 4.307093e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.3533804 -1.4721873 -2.080759 ] [ -0.0375453 -1.625632 3.282176 ] [ -4.4963735 0.5617055 -2.0113431 ] [ -0.6575338 0.4625466 -3.7262737 ] [ 2.4441735 -1.0244611 2.849259 ] [ 1.5366715 0.5565792 -1.1556841 ] [ 2.563988 2.5414491 2.8426248 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.168354453793574e-09 -2.358704092931548e-09 -3.333743450785206e-09 ] [ -6.01542023765202e-11 -2.604549605882688e-09 5.258625695875583e-09 ] [ -7.203984559436798e-09 8.999514272892869e-10 -3.222526917777125e-09 ] [ -1.053485290425229e-09 7.410813546561443e-10 -5.970148654028725e-09 ] [ 3.915997671141999e-09 -1.641367636861937e-09 4.565016194014205e-09 ] [ 2.462019171433731e-09 8.917381892104128e-10 -1.851610061305319e-09 ] [ 4.107961663456392e-09 4.071850364520329e-09 4.554387033788923e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.682899 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.512677433118196e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.029527 1.7348579 2.7148957 ] [ 3.1707349 2.0178428 4.8731287 ] [ 1.2712065 4.0392986 2.486057 ] [ 4.3054838 2.0919165 1.8587771 ] [ 5.2506333 1.3372301 3.9177106 ] [ 3.7140274 4.4181881 2.0765616 ] [ 2.831887 4.3606081 4.4198763 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.029527e-10 1.7348579e-10 2.7148957e-10 ] [ 3.1707349e-10 2.0178428e-10 4.8731287e-10 ] [ 1.2712065e-10 4.039298600000001e-10 2.486057e-10 ] [ 4.3054838e-10 2.0919165e-10 1.8587771e-10 ] [ 5.2506333e-10 1.3372301e-10 3.9177106e-10 ] [ 3.7140274e-10 4.4181881e-10 2.0765616e-10 ] [ 2.831887e-10 4.3606081e-10 4.4198763e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.27e-05 -2.8e-06 3.8e-06 ] [ -2.52e-05 7.2e-06 -3.8e-06 ] [ 3.42e-05 1.95e-05 2.52e-05 ] [ 4.7e-06 -2.89e-05 3.8e-05 ] [ 1.89e-05 -4e-07 -3.32e-05 ] [ -3.52e-05 1.6e-05 3.36e-05 ] [ -1.01e-05 -1.04e-05 -6.34e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.03476432518e-14 -4.486094575199999e-15 6.088271209199999e-15 ] [ -4.037485117679999e-14 1.15356717648e-14 -6.088271209199999e-15 ] [ 5.479444088279999e-14 3.1242444363e-14 4.037485117679999e-14 ] [ 7.530230179799999e-15 -4.63029047226e-14 6.088271209199999e-14 ] [ 3.02811383826e-14 -6.408706536e-16 -5.31922642488e-14 ] [ -5.63966175168e-14 2.5634826144e-14 5.383313490239999e-14 ] [ -1.61819840034e-14 -1.66626369936e-14 -1.015779985956e-13 ] ] } "relaxed-potential-energy" { "source-value" -18.063307 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.894060840816863e-18 } }