{ "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" [ 5.44038 0 0 ] "si-unit" "m" "si-value" [ 5.44038e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0177809 5.34742 0 ] "si-unit" "m" "si-value" [ 1.77809e-12 5.34742e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.258508 -0.216411 5.45927 ] "si-unit" "m" "si-value" [ 2.58508e-11 -2.16411e-11 5.459270000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0111666 -0.0485116 -0.0844937 ] [ 1.40892 1.32935 1.34318 ] [ 0.251238 2.67562 2.78628 ] [ 1.4893 4.10816 4.17197 ] [ 2.79244 -0.0558727 2.81547 ] [ 4.18247 1.3542 3.88471 ] [ 2.61313 2.71504 -0.144964 ] [ 4.08224 4.0407 1.29994 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.11666e-12 -4.851160000000001e-12 -8.44937e-12 ] [ 1.40892e-10 1.32935e-10 1.34318e-10 ] [ 2.51238e-11 2.67562e-10 2.78628e-10 ] [ 1.4893e-10 4.10816e-10 4.17197e-10 ] [ 2.79244e-10 -5.58727e-12 2.81547e-10 ] [ 4.182470000000001e-10 1.3542e-10 3.88471e-10 ] [ 2.61313e-10 2.71504e-10 -1.44964e-11 ] [ 4.08224e-10 4.0407e-10 1.29994e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.2116299 6.2847431 5.7165403 ] [ 0.4023817 -0.9588231 -0.5624025 ] [ -0.9729869 0.766139 -0.6919618 ] [ 4.9838671 -6.7271316 -4.6248509 ] [ -0.02998 1.3847766 -2.5748589 ] [ 1.1119113 -0.8823264 1.272459 ] [ -0.0030824 1.5583693 1.5710937 ] [ -0.280481 -1.4257469 -0.1060189 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.349951582042243e-09 1.006926846255412e-08 9.158907220521019e-09 ] [ 6.446865523777594e-10 -1.536203954302981e-09 -9.01068136979472e-10 ] [ -1.558896863524668e-09 1.227489994083091e-09 -1.108645018446686e-09 ] [ 7.985035348794297e-09 -1.07780529745649e-08 -7.409827986665839e-09 ] [ -4.8033255091584e-11 2.218656693550913e-09 -4.125378731438805e-09 ] [ 1.781478289263335e-09 -1.413642729994629e-09 2.038704060726547e-09 ] [ -4.93854921595392e-12 2.496782859032461e-09 2.517169595226169e-09 ] [ -4.493801007786048e-10 -2.284298350358076e-09 -1.698610029429331e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -32.938766 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.277372080320194e-18 } }