{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.33088e-10 0.0 0.0 ] "source-value" [ 5.33088 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 4.80326e-12 5.46857e-10 0.0 ] "source-value" [ 0.0480326 5.46857 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.09209e-11 1.82969e-11 5.33745e-10 ] "source-value" [ -0.109209 0.182969 5.33745 ] } "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" [ [ 1.61500941466196e-09 -8.961066766378406e-10 8.547839781048154e-10 ] [ -1.818428808015859e-10 -5.165207540321875e-10 1.681971425222323e-10 ] [ 7.274804712165581e-10 -2.268460033373157e-09 6.127615810316986e-10 ] [ 2.959401264575751e-10 1.330617296634125e-10 3.440924232720845e-10 ] [ 3.750568897339757e-10 5.884363742687406e-10 -5.482180560804326e-10 ] [ -7.374561035106452e-10 7.866698423364346e-10 -1.395256952182639e-09 ] [ -9.237075335020244e-10 7.29454993684032e-10 1.781466593374003e-10 ] [ -1.170480544473475e-09 1.443464524090566e-09 -2.145066157874976e-10 ] ] "source-value" [ [ 1.0080096 -0.5593058 0.5335142 ] [ -0.1134974 -0.3223869 0.1049804 ] [ 0.4540576 -1.4158614 0.3824557 ] [ 0.1847113 0.0830506 0.2147656 ] [ 0.2340921 0.3672731 -0.3421708 ] [ -0.4602839 0.4910007 -0.8708509 ] [ -0.5765329 0.45529 0.1111904 ] [ -0.7305565 0.9009397 -0.1338845 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -9.70486e-12 -7.88825e-12 -1.0937e-11 ] [ 1.39157e-10 1.38931e-10 1.26283e-10 ] [ -4.44574e-12 2.82173e-10 2.6602e-10 ] [ 1.24826e-10 4.17435e-10 3.90061e-10 ] [ 2.67605e-10 6.825380000000001e-12 2.80056e-10 ] [ 3.9766e-10 1.50429e-10 4.31462e-10 ] [ 2.81042e-10 2.80539e-10 2.55717e-12 ] [ 4.1826e-10 4.03217e-10 1.44291e-10 ] ] "source-value" [ [ -0.0970486 -0.0788825 -0.10937 ] [ 1.39157 1.38931 1.26283 ] [ -0.0444574 2.82173 2.6602 ] [ 1.24826 4.17435 3.90061 ] [ 2.67605 0.0682538 2.80056 ] [ 3.9766 1.50429 4.31462 ] [ 2.81042 2.80539 0.0255717 ] [ 4.1826 4.03217 1.44291 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 2.51444829823574e-17 "source-value" 156.93952 } }