{ "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" [ [ -6.122565749608224e-10 -2.847998719778285e-09 2.205877893041075e-09 ] [ 2.308325552269565e-09 2.518954580199402e-09 5.275890387381278e-09 ] [ -8.181311437684359e-10 4.634419243263801e-10 -6.556767469952017e-09 ] [ 2.967992776487129e-09 1.580294252730776e-09 -2.712128694933934e-09 ] [ -8.083781980028738e-09 7.735321542635366e-10 2.920586292889601e-09 ] [ -1.548511714886304e-10 2.317134639766048e-09 -3.005819365415906e-09 ] [ -1.133690563818355e-10 -4.981832017364832e-10 2.168518979467909e-09 ] [ 4.50607159787177e-09 -4.307175469553712e-09 -2.961578622603418e-10 ] ] "source-value" [ [ -0.3821405 -1.777581 1.3768007 ] [ 1.4407435 1.5722078 3.2929518 ] [ -0.5106373 0.2892577 -4.0924124 ] [ 1.8524754 0.9863421 -1.6927776 ] [ -5.0454999 0.4828008 1.8228866 ] [ -0.0966505 1.4462417 -1.8760849 ] [ -0.0707594 -0.3109415 1.3534831 ] [ 2.8124687 -2.6883275 -0.1848472 ] ] } "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" -5.657570034394992e-18 "source-value" -35.311775 } }