{ "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" [ [ 0.9561271 0.2009027 2.827783 ] [ 0.6408175 2.004915 2.928704 ] [ 2.494403 2.793601 0.1007886 ] [ 2.213716 1.735143 2.110523 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.561271000000001e-11 2.009027e-11 2.827783e-10 ] [ 6.408175e-11 2.004915e-10 2.928704e-10 ] [ 2.494403e-10 2.793601e-10 1.007886e-11 ] [ 2.213716e-10 1.735143e-10 2.110523e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.5518642 -12.8889519 0.9930862 ] [ -10.8999538 10.8290756 5.2189509 ] [ -0.2976103 -0.1800721 0.0878801 ] [ 12.7494283 2.2399483 -6.2999171 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.486360539896496e-09 -2.065037740079574e-08 1.591099492079113e-09 ] [ -1.746365114616012e-08 1.735009175119573e-08 8.36168111708312e-09 ] [ -4.768242647692742e-10 -2.885073086783597e-10 1.407994416535661e-10 ] [ 2.042683595082589e-08 3.588792798060705e-09 -1.009357989059814e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -0.0016123392 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.583252171039376e-22 } "relaxed-configuration-positions" { "source-value" [ [ 0.9942982 0.0415809 2.5212974 ] [ 0.3637661 2.264976 3.2196093 ] [ 2.4344512 2.539596 0.0415108 ] [ 2.5125482 1.8884088 2.1853811 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.942982000000001e-11 4.15809e-12 2.5212974e-10 ] [ 3.637661e-11 2.264976e-10 3.2196093e-10 ] [ 2.4344512e-10 2.539596e-10 4.151080000000001e-12 ] [ 2.5125482e-10 1.8884088e-10 2.1853811e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2e-07 7e-07 0.0 ] [ 0.0 -3e-07 -3e-07 ] [ -2e-07 0.0 -0.0 ] [ -0.0 -5e-07 3e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.2043532416e-16 1.12152363456e-15 0.0 ] [ 0.0 -4.8065298624e-16 -4.8065298624e-16 ] [ -3.2043532416e-16 0.0 0.0 ] [ 0.0 -8.010883104e-16 4.8065298624e-16 ] ] } "relaxed-potential-energy" { "source-value" -5.3664727 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.598037096101453e-19 } }