{ "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" [ 5.4 0 0 ] "si-unit" "m" "si-value" [ 5.400000000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.386566 5.8038 0 ] "si-unit" "m" "si-value" [ 3.86566e-11 5.8038e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.433064 -0.220286 5.20849 ] "si-unit" "m" "si-value" [ -4.33064e-11 -2.20286e-11 5.20849e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 6.053553400000002 -17.645067000000004 19.197335600000002 ] [ -19.426705400000003 2.0747976000000006 -98.04012220000003 ] [ 230.80402190000007 -210.79825690000007 212.12245380000005 ] [ 16.193607600000004 2.3006479000000004 7.220600300000002 ] [ 48.443425900000015 -41.11819520000001 59.462742300000016 ] [ -5.105068400000001 22.722079100000002 -16.151367800000003 ] [ -15.791819700000003 -6.2484711000000015 -7.599435400000002 ] [ -261.1710153000001 248.71246560000006 -176.21220660000003 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.698861730244354e-09 -2.82705138198496e-08 3.075752227997154e-08 ] [ -3.112501321104911e-08 3.324192207611951e-09 -1.570775916892151e-07 ] [ 3.697888078747913e-07 -3.377360389105724e-07 3.398576362250882e-07 ] [ 2.59450195031292e-08 3.686044278072617e-09 1.156867698880147e-08 ] [ 7.761492440843722e-08 -6.58786110389308e-08 9.526981552171525e-08 ] [ -8.179221238064866e-09 3.640478390998831e-08 -2.587734388310193e-08 ] [ -2.530128432322888e-08 -1.001115431216446e-08 -1.21756377291599e-08 ] [ -4.184420947442593e-07 3.984812976858444e-07 -2.823230777140995e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 66.546128 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.066186504863643e-17 } }