{ "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" [ 5.47435 0 0 ] "si-unit" "m" "si-value" [ 5.474350000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.716605 5.34737 0 ] "si-unit" "m" "si-value" [ -7.16605e-11 5.34737e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.276149 -0.165536 5.69815 ] "si-unit" "m" "si-value" [ -2.76149e-11 -1.65536e-11 5.698150000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.269074 0.0407786 -0.111283 ] [ 1.40941 1.27172 1.01322 ] [ -0.306599 2.71071 2.41068 ] [ 1.07784 4.29368 3.98414 ] [ 2.55814 0.158673 3.18004 ] [ 3.994 1.24784 4.28471 ] [ 2.16355 2.62993 -0.160126 ] [ 3.70597 4.39593 1.80666 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.69074e-11 4.07786e-12 -1.11283e-11 ] [ 1.40941e-10 1.27172e-10 1.01322e-10 ] [ -3.06599e-11 2.71071e-10 2.41068e-10 ] [ 1.07784e-10 4.29368e-10 3.98414e-10 ] [ 2.55814e-10 1.58673e-11 3.18004e-10 ] [ 3.994e-10 1.24784e-10 4.28471e-10 ] [ 2.16355e-10 2.62993e-10 -1.60126e-11 ] [ 3.70597e-10 4.39593e-10 1.80666e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.9971501 -2.9758966 -1.8151455 ] [ -1.1754892 0.3415668 6.3445893 ] [ 2.3461197 -2.2308595 2.7966175 ] [ -6.2901692 -5.839948 4.0892919 ] [ 2.401217 3.1110519 -8.0598611 ] [ -0.6638669 4.5059357 1.6701175 ] [ 5.5927112 1.0359239 -4.5193605 ] [ -1.2133726 2.0522259 -0.5062491 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.597610590810763e-09 -4.767911997720044e-09 -2.908183707410247e-09 ] [ -1.883341329759353e-09 5.472503459101511e-10 1.016515272878642e-08 ] [ 3.75889816390709e-09 -3.574230964636923e-09 4.480675212735495e-09 ] [ -1.007796211614647e-08 -9.356628229375031e-09 6.551767931785464e-09 ] [ 3.847173770563577e-09 4.984454661341305e-09 -1.291332112770554e-08 ] [ -1.063632035266015e-09 7.219304892846434e-09 2.675823234534495e-09 ] [ 8.9605112053501e-09 1.659733067182153e-09 -7.240813793722556e-09 ] [ -1.944037228055828e-09 3.28802838466962e-09 -8.111004790035293e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -27.372938 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.385628166753069e-18 } }