{ "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" [ 5.40534 0 0 ] "si-unit" "m" "si-value" [ 5.40534e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0241155 5.39517 0 ] "si-unit" "m" "si-value" [ 2.41155e-12 5.395170000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0520891 0.00914509 5.32386 ] "si-unit" "m" "si-value" [ -5.20891e-12 9.14509e-13 5.32386e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0541257 0.0304247 -0.104173 ] [ 1.34 1.36746 1.32858 ] [ -0.0983731 2.60813 2.63031 ] [ 1.3236 4.08084 4.09012 ] [ 2.69861 0.0115312 2.71277 ] [ 4.03614 1.39677 4.05029 ] [ 2.56533 2.8449 0.01686 ] [ 4.17154 4.11014 1.29552 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.41257e-12 3.04247e-12 -1.04173e-11 ] [ 1.34e-10 1.36746e-10 1.32858e-10 ] [ -9.837310000000001e-12 2.60813e-10 2.63031e-10 ] [ 1.3236e-10 4.08084e-10 4.09012e-10 ] [ 2.69861e-10 1.15312e-12 2.71277e-10 ] [ 4.03614e-10 1.39677e-10 4.05029e-10 ] [ 2.56533e-10 2.8449e-10 1.686e-12 ] [ 4.17154e-10 4.11014e-10 1.29552e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5666284 0.5089984 0.5177536 ] [ 1.0192414 -1.1066596 0.137825 ] [ 0.6310901 0.8178446 0.3566512 ] [ -0.9389686 -0.1805977 -3.2499509 ] [ -0.2165828 -0.737985 -0.6623815 ] [ -2.3834893 2.0017766 0.9503445 ] [ 1.7963981 -1.2489613 1.2028771 ] [ -0.4743173 -0.0544161 0.7468811 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.078387751613108e-10 8.155053365046067e-10 8.295327132550349e-10 ] [ 1.633004742031461e-09 -1.77306413830388e-09 2.2081999276176e-10 ] [ 1.011117803838334e-09 1.310331497567528e-09 5.71418214420265e-10 ] [ -1.504393538585307e-09 -2.893494127102522e-10 -5.206995350727918e-09 ] [ -3.470038986274022e-10 -1.182382313501088e-09 -1.061252153350435e-09 ] [ -3.818770832386957e-09 3.207199668584513e-09 1.522619739605866e-09 ] [ 2.878147037469541e-09 -2.001056595143975e-09 1.927221567315704e-09 ] [ -7.599400889009799e-10 -8.718420321511489e-11 1.196635436937387e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -220.79897 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.537589476307206e-17 } }