{ "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" [ 5.29616 0 0 ] "si-unit" "m" "si-value" [ 5.29616e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.242438 5.47618 0 ] "si-unit" "m" "si-value" [ -2.42438e-11 5.47618e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.11809 -0.0034447 5.45685 ] "si-unit" "m" "si-value" [ 1.1809e-11 -3.4447e-13 5.456850000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0183909 -0.0832388 -0.0590634 ] [ 1.37993 1.35458 1.33752 ] [ -0.123201 2.75975 2.68859 ] [ 1.45379 4.06883 4.12913 ] [ 2.80695 0.0674874 2.75473 ] [ 4.11558 1.36445 4.01895 ] [ 2.83757 2.84317 -0.0421665 ] [ 3.94058 4.22423 1.31424 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.83909e-12 -8.32388e-12 -5.90634e-12 ] [ 1.37993e-10 1.35458e-10 1.33752e-10 ] [ -1.23201e-11 2.75975e-10 2.68859e-10 ] [ 1.45379e-10 4.06883e-10 4.12913e-10 ] [ 2.80695e-10 6.748740000000001e-12 2.75473e-10 ] [ 4.11558e-10 1.36445e-10 4.01895e-10 ] [ 2.83757e-10 2.84317e-10 -4.21665e-12 ] [ 3.94058e-10 4.224230000000001e-10 1.31424e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.7064113 1.5203639 -0.8286174 ] [ -0.0870962 0.3346306 0.007183 ] [ 1.9740375 0.552345 -0.5277745 ] [ -1.2557363 0.2877149 -0.2749822 ] [ 0.2851142 -0.5293122 -0.9779098 ] [ -0.3496685 -0.1642719 1.2264917 ] [ -1.3761557 -1.0471733 -0.1265296 ] [ -0.8969062 -0.954297 1.5021388 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.733972290328935e-09 2.435891495688309e-09 -1.327591425868082e-09 ] [ -1.39543495400521e-10 5.361373239242765e-10 1.15084346672064e-11 ] [ 3.16275673108248e-09 8.849542456157759e-10 -8.455879649544096e-10 ] [ -2.011911341749895e-09 4.609700862358099e-10 -4.405700519761498e-10 ] [ 4.568033054980953e-10 -8.480516319442139e-10 -1.566784218811204e-09 ] [ -5.602306957302048e-10 -2.631925976343955e-10 1.965056327345247e-09 ] [ -2.204844489120659e-09 -1.677756579185985e-09 -2.027227669591757e-10 ] [ -1.437002144690569e-09 -1.528952342699578e-09 2.406691666556567e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.714978 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.882387938478635e-18 } }