{ "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" [ [ -0.2264243 -1.0174604 0.5397977 ] [ 0.8983509 0.7809704 2.0855014 ] [ -0.2525792 0.1099913 -2.4211583 ] [ 1.3358232 0.8257564 -0.9919428 ] [ -2.9558543 0.9314376 1.4055233 ] [ -0.6065042 0.5781993 -0.6421951 ] [ 0.0401862 -0.0045096 0.5703096 ] [ 1.7670017 -2.2043849 -0.5458358 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.627717198410054e-10 -1.630151265469817e-09 8.648512549016123e-10 ] [ 1.439316809254639e-09 1.251252516416824e-09 3.341341585725669e-09 ] [ -4.046764891403674e-10 1.76225489351399e-10 -3.879123223515873e-09 ] [ 2.140224700562243e-09 1.323007598555973e-09 -1.58926756333089e-09 ] [ -4.735800653951149e-09 1.492327546454062e-09 2.251896571249665e-09 ] [ -9.717268496570074e-10 9.263774006229254e-10 -1.028909975212318e-09 ] [ 6.438539011879296e-11 -7.22517568915968e-12 9.137367077377996e-10 ] [ 2.831048812653855e-09 -3.531813950024546e-09 -8.745253575556646e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -17.083252038775914 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.737038702376071e-18 } }