{ "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" [ [ 0.7593129 0.4467522 -3.9702762 ] [ 0.512414 -0.481914 4.3379293 ] [ 0.7129202 -1.8044209 1.6495482 ] [ -1.7525848 -1.5441091 2.4888498 ] [ 1.3696049 2.5974837 -2.844683 ] [ 0.7809237 -0.5847601 -2.0539009 ] [ 0.6806001 1.9036399 -0.9040477 ] [ -3.063191 -0.5326717 1.2965804 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.216553376251848e-09 7.157759301309658e-10 -6.361083705758664e-09 ] [ 8.209777309706114e-10 -7.721113440362112e-10 6.950128907143309e-09 ] [ 1.14222407693606e-09 -2.891000980062895e-09 2.642867560922723e-09 ] [ -2.807950392529444e-09 -2.473935499984529e-09 3.987576962242756e-09 ] [ 2.194348950513122e-09 4.161627657049081e-09 -4.557684596187206e-09 ] [ 1.251177694768633e-09 -9.368889609966701e-10 -3.290712003420079e-09 ] [ 1.090441568334142e-09 3.04996734220205e-09 -1.448444089028012e-09 ] [ -4.907773005244973e-09 -8.534341443017913e-10 2.077350803867512e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.527533 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.692138276730049e-18 } }