{ "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" [ [ 1.0312241 1.1568644 -3.3471477 ] [ 0.0603774 -0.1744437 2.7826606 ] [ 0.8135303 -1.3966415 1.4495275 ] [ -2.0711618 -2.0215414 2.2326135 ] [ 2.105834 2.4152613 -2.3094446 ] [ 0.5312317 -0.5250226 -1.2867301 ] [ 0.7588572 1.5625327 -0.8431601 ] [ -3.229893 -1.0170091 1.3216809 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.652203157437679e-09 1.853501110386429e-09 -5.362721835486841e-09 ] [ 9.673525950167158e-11 -2.794896200885057e-10 4.45831379367242e-09 ] [ 1.30341923771101e-09 -2.237666377374711e-09 2.322399090840435e-09 ] [ -3.318367041193381e-09 -3.238866395743647e-09 3.577041182452958e-09 ] [ 3.373918029882756e-09 3.869675219864464e-09 -3.700138175637476e-09 ] [ 8.511270169800976e-10 -8.411789420419283e-10 -2.061568900484483e-09 ] [ 1.215823274382665e-09 2.503453381800932e-09 -1.350891410941103e-09 ] [ -5.174859094920162e-09 -1.629428216585369e-09 2.117566255584091e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -25.365170074190157 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.063948281030352e-18 } }