{ "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" [ [ 1.137105 0.4960836 2.336745 ] [ 0.1995221 2.603398 2.709633 ] [ 1.958667 0.0128645 0.3845919 ] [ 2.315861 1.899112 1.511593 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.137105e-10 4.960836e-11 2.336745e-10 ] [ 1.995221e-11 2.603398e-10 2.709633e-10 ] [ 1.958667e-10 1.28645e-12 3.845919e-11 ] [ 2.315861e-10 1.899112e-10 1.511593e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.3244852 -5.3714584 6.5770783 ] [ -1.0334986 1.3652162 0.4749698 ] [ 1.0129256 -3.8900944 -5.5564117 ] [ 5.3450583 7.8963365 -1.4956364 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.530765705235612e-09 -8.606025068079774e-09 1.053764108543101e-08 ] [ -1.655847294549531e-09 2.187317477977417e-09 7.609855091460518e-10 ] [ 1.622885714929812e-09 -6.232618300385004e-09 -8.902352921279584e-09 ] [ 8.563727445072993e-09 1.26513257302697e-08 -2.396273673297477e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.9378637 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.513506397636987e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.4899692 0.052079 2.418881 ] [ 0.6796562 2.3659064 2.7256808 ] [ 2.1259297 0.1398206 0.7456087 ] [ 2.3156 2.453652 1.0523924 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.899692e-11 5.2079e-12 2.418881e-10 ] [ 6.796562e-11 2.3659064e-10 2.7256808e-10 ] [ 2.1259297e-10 1.398206e-11 7.456087000000001e-11 ] [ 2.3156e-10 2.453652e-10 1.0523924e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7e-07 -6.1e-06 5.9e-06 ] [ -3.5e-06 1.4e-06 -4.1e-06 ] [ -4.1e-06 4e-06 -2.9e-06 ] [ 6.9e-06 7e-07 1.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.12152363456e-15 -9.77327738688e-15 9.45284206272e-15 ] [ -5.6076181728e-15 2.24304726912e-15 -6.568924145279999e-15 ] [ -6.568924145279999e-15 6.4087064832e-15 -4.646312200320001e-15 ] [ 1.105501868352e-14 1.12152363456e-15 1.76239428288e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.9297943 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.43071076560131e-18 } }