{ "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" [ 5.18551 0 0 ] "si-unit" "m" "si-value" [ 5.18551e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.238045 5.44258 0 ] "si-unit" "m" "si-value" [ 2.38045e-11 5.44258e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0219846 -0.0831786 5.06218 ] "si-unit" "m" "si-value" [ 2.19846e-12 -8.31786e-12 5.06218e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0772431 0.350103 0.202788 ] [ 1.30878 1.27698 1.65073 ] [ 0.0902711 2.6496 2.76502 ] [ 1.60148 3.65596 4.18013 ] [ 2.76894 -0.178197 3.21948 ] [ 3.70957 1.45836 3.94737 ] [ 2.83791 2.83658 -0.151442 ] [ 4.06532 3.74454 1.70854 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.72431e-12 3.50103e-11 2.02788e-11 ] [ 1.30878e-10 1.27698e-10 1.65073e-10 ] [ 9.02711e-12 2.6496e-10 2.76502e-10 ] [ 1.60148e-10 3.65596e-10 4.18013e-10 ] [ 2.76894e-10 -1.78197e-11 3.21948e-10 ] [ 3.70957e-10 1.45836e-10 3.94737e-10 ] [ 2.83791e-10 2.83658e-10 -1.51442e-11 ] [ 4.06532e-10 3.74454e-10 1.70854e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7483607 -2.9082438 0.130468 ] [ 3.0550105 -2.0301933 -0.3792968 ] [ 2.2241485 0.1961131 0.4695959 ] [ -6.7327333 4.9929797 -0.6975871 ] [ -1.2991557 -1.119414 -2.1713666 ] [ 2.9030774 -3.5946737 -1.2415391 ] [ 1.7454277 0.4601869 7.500142 ] [ -1.1474144 4.0032451 -3.6104163 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.199006017465523e-09 -4.659520223946551e-09 2.090327793625344e-10 ] [ 4.894666399398519e-09 -3.252728240964801e-09 -6.077004653042535e-10 ] [ 3.563478727887389e-09 3.142078238526125e-10 7.523755722035348e-10 ] [ -1.078702788734163e-08 7.999635343468998e-09 -1.117657742591672e-09 ] [ -2.081476889319059e-09 -1.793498939796211e-09 -3.478912801705985e-09 ] [ 4.65124273865285e-09 -5.759302161544633e-09 -1.989164919829073e-09 ] [ 2.796483454236716e-09 7.373006923784276e-10 1.201655216508015e-08 ] [ -1.83836052604926e-09 6.413905706552158e-09 -5.784524587215239e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 746.36947 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.195815715312887e-16 } }