{ "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" [ 5.46438 0 0 ] "si-unit" "m" "si-value" [ 5.46438e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0372754 5.43203 0 ] "si-unit" "m" "si-value" [ 3.72754e-12 5.432030000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.17857 -0.0223871 5.50346 ] "si-unit" "m" "si-value" [ 1.7857e-11 -2.23871e-12 5.503459999999999e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00726127 0.010583 0.00336114 ] [ 1.28417 1.2786 1.26313 ] [ 0.0794421 2.71348 2.73185 ] [ 1.57701 4.05847 4.12903 ] [ 2.78941 -0.159624 2.68623 ] [ 4.22148 1.3448 3.91745 ] [ 2.73822 2.68922 0.00939316 ] [ 4.14349 4.04668 1.21083 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.26127e-13 1.0583e-12 3.36114e-13 ] [ 1.28417e-10 1.2786e-10 1.26313e-10 ] [ 7.944210000000001e-12 2.71348e-10 2.73185e-10 ] [ 1.57701e-10 4.05847e-10 4.12903e-10 ] [ 2.78941e-10 -1.59624e-11 2.68623e-10 ] [ 4.22148e-10 1.3448e-10 3.91745e-10 ] [ 2.73822e-10 2.68922e-10 9.39316e-13 ] [ 4.14349e-10 4.04668e-10 1.21083e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0512488 -0.0991937 -2.0313754 ] [ 1.6483747 0.550652 1.6396641 ] [ 0.4152582 0.7016872 -1.006381 ] [ -0.7916137 -0.8537217 0.2170827 ] [ -0.0136394 1.6398672 -0.8223097 ] [ -0.4327721 -0.9310309 1.8204691 ] [ -0.2045109 -0.5171464 -1.2150801 ] [ 0.4301519 -0.4911138 1.3979302 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.684286250004055e-09 -1.589258270706489e-10 -3.254622173948248e-09 ] [ 2.640987406658214e-09 8.822417605967616e-10 2.627031486985073e-09 ] [ 6.653169796354907e-10 1.124226826954614e-09 -1.612400109817325e-09 ] [ -1.268304962844985e-09 -1.367812948409631e-09 3.478048267201401e-10 ] [ -2.185272780173952e-11 2.627356889056758e-09 -1.317485376397062e-09 ] [ -6.933773407545197e-10 -1.491675941222383e-09 2.916713030908817e-09 ] [ -3.276625826787667e-10 -8.285598716108852e-10 -1.946772928619326e-09 ] [ 6.891793175726995e-10 -7.868510485122471e-10 2.239731083950268e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -23.203315 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.717580881805795e-18 } }