{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.474350000000001e-10 0.0 0.0 ] "source-value" [ 5.47435 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -7.16605e-11 5.34737e-10 0.0 ] "source-value" [ -0.716605 5.34737 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.76149e-11 -1.65536e-11 5.698150000000001e-10 ] "source-value" [ -0.276149 -0.165536 5.69815 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -5.622667578016837e-09 -7.069390769136447e-09 -5.65477375553871e-09 ] [ -2.701149939857564e-09 -2.281283694828378e-09 1.728556440822834e-08 ] [ 2.74402707014809e-09 -2.242509258210735e-09 4.382945125651599e-09 ] [ -2.563049332678203e-08 -3.434671353935785e-08 2.092168550366747e-08 ] [ 1.691552249153513e-08 2.68694694852773e-08 -2.752312710520791e-08 ] [ 3.920600211657481e-09 7.9295063103823e-09 2.861917949606809e-09 ] [ 1.37490123412831e-08 1.175059933756344e-08 -7.741519082239946e-09 ] [ -3.374851269967363e-09 -6.096777114719828e-10 -4.532692883949995e-09 ] ] "source-value" [ [ -3.5093931 -4.4123667 -3.5294322 ] [ -1.6859252 -1.4238653 10.7888008 ] [ 1.712687 -1.3996642 2.7356192 ] [ -15.9972958 -21.4375326 13.0582891 ] [ 10.5578388 16.7706039 -17.1785849 ] [ 2.4470462 4.9492086 1.7862687 ] [ 8.5814586 7.3341473 -4.8318762 ] [ -2.1064165 -0.3805309 -2.8290844 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.532827486954864e-18 "source-value" -22.050175 } }