{ "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" [ [ -0.9430131 -0.9569087 3.0375564 ] [ 0.233004 -0.3405687 -2.4147076 ] [ -1.2449601 1.2724718 -1.1849224 ] [ 2.4418026 1.9435542 -1.8538297 ] [ -2.4057359 -1.8588269 2.4601596 ] [ -0.4648131 0.5752179 0.8867235 ] [ -0.9555676 -1.5068921 0.1705801 ] [ 3.3392832 0.8719525 -1.10156 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.510873554375905e-09 -1.533136760011315e-09 4.866701888537157e-09 ] [ 3.73313564428536e-10 -5.456512134117557e-10 -3.868788094662218e-09 ] [ -1.994645982482303e-09 2.038724585383921e-09 -1.898454982383201e-09 ] [ 3.912199070560448e-09 3.113917126152562e-09 -2.970162628755229e-09 ] [ -3.85441384655496e-09 -2.978169025830654e-09 3.941610227030786e-09 ] [ -7.447126879971052e-10 9.216006788385485e-10 1.420687672518699e-09 ] [ -1.530988080927458e-09 -2.414307312579191e-09 2.732994504453834e-10 ] [ 5.350121517348749e-09 1.397021921457885e-09 -1.76489369294904e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.03496760156247802 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.602427417042418e-21 } }