{ "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" [ 5.47042 0 0 ] "si-unit" "m" "si-value" [ 5.47042e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0146058 5.3888 0 ] "si-unit" "m" "si-value" [ 1.46058e-12 5.3888e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.134413 -0.103851 5.39218 ] "si-unit" "m" "si-value" [ 1.34413e-11 -1.03851e-11 5.39218e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0813222 0.0658783 -0.0148119 ] [ 1.29496 1.3028 1.25678 ] [ 0.00731236 2.63688 2.91411 ] [ 1.38293 3.97853 4.11798 ] [ 2.91023 -0.000259257 2.64672 ] [ 4.15592 1.24599 4.16086 ] [ 2.63613 2.74458 -0.00927687 ] [ 4.0418 4.10114 1.35651 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -8.13222e-12 6.58783e-12 -1.48119e-12 ] [ 1.29496e-10 1.3028e-10 1.25678e-10 ] [ 7.31236e-13 2.63688e-10 2.91411e-10 ] [ 1.38293e-10 3.97853e-10 4.11798e-10 ] [ 2.91023e-10 -2.59257e-14 2.64672e-10 ] [ 4.15592e-10 1.24599e-10 4.16086e-10 ] [ 2.63613e-10 2.74458e-10 -9.27687e-13 ] [ 4.0418e-10 4.10114e-10 1.35651e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2641351 -1.2169233 0.7776091 ] [ 0.9327245 0.8978125 2.1313435 ] [ -0.2517473 0.122859 -2.577561 ] [ 1.2572248 0.7625073 -0.9239544 ] [ -3.3991382 1.1749025 1.8365307 ] [ -0.6504655 0.6488831 -0.9516923 ] [ 0.2827058 0.021152 0.7813115 ] [ 2.0928309 -2.4111933 -1.073587 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.231910819526701e-10 -1.949726060566784e-09 1.245867120141329e-09 ] [ 1.49438938754737e-09 1.438454197362e-09 3.414788726594044e-09 ] [ -4.033436384095239e-10 1.968418174548672e-10 -4.129707972885869e-09 ] [ 2.014296181649956e-09 1.221671369249332e-09 -1.480338138365292e-09 ] [ -5.446019754908195e-09 1.882401317219472e-09 2.942446550921458e-09 ] [ -1.042160616736983e-09 1.039625332452229e-09 -1.52477915325538e-09 ] [ 4.529446233245607e-10 3.38892398831616e-11 1.251799018862179e-09 ] [ 3.353084739267823e-09 -3.863157533489601e-09 -1.72007599179481e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.894001 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.750852922917183e-18 } }