{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.400000000000001e-10 0.0 0.0 ] "source-value" [ 5.4 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 3.86566e-11 5.8038e-10 0.0 ] "source-value" [ 0.386566 5.8038 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -4.33064e-11 -2.20286e-11 5.20849e-10 ] "source-value" [ -0.433064 -0.220286 5.20849 ] } "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" [ [ 1.06733305449702e-09 -1.796701530643528e-09 4.701844763520562e-09 ] [ -5.74037612977611e-10 2.330518582385562e-09 -6.5867437138742e-09 ] [ 4.484798056918449e-09 -6.645656228874002e-09 1.039652681607146e-08 ] [ 2.770743044864606e-09 1.455437910413128e-09 2.360515975039138e-09 ] [ 1.882887738041547e-09 -5.449309183728359e-09 3.494619740207998e-09 ] [ -1.04464222810494e-09 9.158269073572953e-10 -4.612376497314835e-09 ] [ -1.518623430460604e-09 -1.285791278702058e-09 -2.478146981449964e-09 ] [ -7.068458622778466e-09 1.047567482179196e-08 -7.276240262417817e-09 ] ] "source-value" [ [ 0.6661769000000001 -1.1214129000000002 2.9346607000000002 ] [ -0.35828610000000005 1.4545953000000003 -4.111122100000001 ] [ 2.7991908000000003 -4.147892400000001 6.489001700000002 ] [ 1.7293618000000004 0.9084129000000002 1.4733182000000002 ] [ 1.1752061000000003 -3.4011913000000007 2.1811701000000006 ] [ -0.6520144000000001 0.5716142000000001 -2.8788190000000005 ] [ -0.9478502000000002 -0.8025278000000002 -1.5467377000000004 ] [ -4.411784900000001 6.538402000000001 -4.541472000000001 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -9.90081e-12 -2.44555e-11 -2.90689e-11 ] [ 1.37678e-10 1.31208e-10 1.41317e-10 ] [ 1.46167e-11 2.66383e-10 2.23753e-10 ] [ 1.10278e-10 3.83154e-10 3.71513e-10 ] [ 2.55958e-10 4.22069e-11 2.77183e-10 ] [ 3.95966e-10 1.45431e-10 4.356900000000001e-10 ] [ 2.78855e-10 2.68274e-10 3.81413e-11 ] [ 4.33575e-10 3.68618e-10 1.46711e-10 ] ] "source-value" [ [ -0.0990081 -0.244555 -0.290689 ] [ 1.37678 1.31208 1.41317 ] [ 0.146167 2.66383 2.23753 ] [ 1.10278 3.83154 3.71513 ] [ 2.55958 0.422069 2.77183 ] [ 3.95966 1.45431 4.3569 ] [ 2.78855 2.68274 0.381413 ] [ 4.33575 3.68618 1.46711 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.791112597431029e-18 "source-value" -29.903773 } }