{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.47042e-10 0.0 0.0 ] "source-value" [ 5.47042 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.46058e-12 5.3888e-10 0.0 ] "source-value" [ 0.0146058 5.3888 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.34413e-11 -1.03851e-11 5.39218e-10 ] "source-value" [ 0.134413 -0.103851 5.39218 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 2.21304266667163e-09 -3.72319586999105e-09 3.31566061710619e-09 ] [ 3.938163912645339e-09 6.050146725477415e-09 -9.132899247653234e-09 ] [ 1.463018288659119e-09 -3.78724592454311e-10 8.760532412465582e-09 ] [ -3.103628242674194e-09 -8.725324901658824e-09 4.288355982530471e-09 ] [ 4.830908581862093e-09 7.103887874829541e-09 8.597157661354295e-09 ] [ -5.413389505413658e-09 4.015086655257216e-09 -6.757318806937024e-09 ] [ -2.614041519596613e-09 -1.435047649430855e-09 2.682591928058838e-09 ] [ -1.314074182153717e-09 -2.906828081811468e-09 -1.175408054692512e-08 ] ] "source-value" [ [ 1.3812726 -2.3238361 2.0694726 ] [ 2.4580086 3.7762046 -5.7003074 ] [ 0.9131442 -0.2363813 5.4678943 ] [ -1.9371324 -5.4459195 2.6765813 ] [ 3.015216 4.4338981 5.3659238 ] [ -3.378772 2.50602 -4.2175867 ] [ -1.6315564 -0.8956863 1.6743422 ] [ -0.8201806 -1.8142994 -7.3363201 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.941104728001539e-18 "source-value" -18.356932 } }