{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.441642 1.737365 1.840337 ] [ 1.815126 3.688812 0.8905128 ] [ 2.603472 3.479991 3.236515 ] [ 3.869651 3.231599 1.101882 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.441642e-10 1.737365e-10 1.840337e-10 ] [ 1.815126e-10 3.688812e-10 8.905128000000001e-11 ] [ 2.603472e-10 3.479991e-10 3.236515e-10 ] [ 3.869651e-10 3.231599e-10 1.101882e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.9250773 -19.508863 6.9574055 ] [ -28.6334998 15.2408309 -17.8635658 ] [ -1.6952205 2.1321105 22.0895201 ] [ 35.2537975 2.1359216 -11.1833598 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.890843770703808e-09 -3.125664445450714e-08 1.114699252536309e-08 ] [ -4.587592432920367e-08 2.441850315072519e-08 -2.862058772468151e-08 ] [ -2.716042674577797e-09 3.416017624206057e-09 3.539131296049334e-08 ] [ 5.648281061426761e-08 3.422123679575894e-09 -1.791771776117491e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -0.20888522 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.346710186719494e-20 } "relaxed-configuration-positions" { "source-value" [ [ 2.3513057 1.4066712 1.8027049 ] [ 1.5452279 3.8109028 0.837611 ] [ 2.6422002 3.641557 3.3133874 ] [ 4.1911573 3.2786359 1.1155435 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3513057e-10 1.4066712e-10 1.8027049e-10 ] [ 1.5452279e-10 3.8109028e-10 8.37611e-11 ] [ 2.6422002e-10 3.641557e-10 3.3133874e-10 ] [ 4.191157300000001e-10 3.2786359e-10 1.1155435e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1e-07 2e-07 -6e-07 ] [ 2e-07 -4e-07 -6e-07 ] [ 8e-07 4e-07 7e-07 ] [ -1e-06 -1e-07 5e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.602176634e-16 3.204353268e-16 -9.613059803999998e-16 ] [ 3.204353268e-16 -6.408706536e-16 -9.613059803999998e-16 ] [ 1.2817413072e-15 6.408706536e-16 1.1215236438e-15 ] [ -1.602176634e-15 -1.602176634e-16 8.010883169999999e-16 ] ] } "relaxed-potential-energy" { "source-value" -12.114379 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.940937496922028e-18 } }