{ "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" [ 5.41643 0 0 ] "si-unit" "m" "si-value" [ 5.41643e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0584288 5.39313 0 ] "si-unit" "m" "si-value" [ 5.84288e-12 5.39313e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0447548 0.203328 5.3475 ] "si-unit" "m" "si-value" [ -4.47548e-12 2.03328e-11 5.3475e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0133581 0.0277146 -0.124532 ] [ 1.5025 1.22494 1.34546 ] [ 0.0458685 2.70233 2.56072 ] [ 1.46199 4.10879 4.17844 ] [ 2.74075 -0.0340431 2.6907 ] [ 4.13695 1.41216 4.09761 ] [ 2.75898 2.67415 0.0540851 ] [ 4.02257 4.13506 1.27654 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.33581e-12 2.77146e-12 -1.24532e-11 ] [ 1.5025e-10 1.22494e-10 1.34546e-10 ] [ 4.58685e-12 2.70233e-10 2.56072e-10 ] [ 1.46199e-10 4.10879e-10 4.17844e-10 ] [ 2.74075e-10 -3.40431e-12 2.6907e-10 ] [ 4.13695e-10 1.41216e-10 4.09761e-10 ] [ 2.75898e-10 2.67415e-10 5.40851e-12 ] [ 4.02257e-10 4.13506e-10 1.27654e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.7986453 -3.4450909 5.2953804 ] [ -3.1439909 2.6170422 -0.8756468 ] [ 0.7856426 0.4888888 2.5703534 ] [ -3.0308493 0.4308166 -5.5011271 ] [ 0.7190722 0.9036919 2.3539566 ] [ -2.9875733 3.1826996 -4.99989 ] [ 2.1786502 -2.286084 0.9598301 ] [ 2.6804032 -1.8919641 0.1971434 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.483924069571803e-09 -5.519644096510831e-09 8.484134675122553e-09 ] [ -5.03722871598795e-09 4.192963828486998e-09 -1.402940831038333e-09 ] [ 1.258738206024526e-09 7.832862055309671e-10 4.118160124673791e-09 ] [ -4.855955889628046e-09 6.902442843725453e-10 -8.813777227669304e-09 ] [ 1.152080667507222e-09 1.447874034586332e-09 3.771454230897857e-09 ] [ -4.786620094186306e-09 5.099246890149511e-09 -8.010706864571713e-09 ] [ 3.490582415341244e-09 -3.662710337984947e-09 1.537817346160126e-09 ] [ 4.294479341357507e-09 -3.031260648412913e-09 3.158585464250227e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -34.599523 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.543454684143188e-18 } }