{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.91343 2.805447 1.311156 ] [ 2.653002 2.505168 3.277079 ] [ 1.829519 4.618852 2.376516 ] [ 4.982305 1.900488 2.423676 ] [ 4.143762 3.996307 2.985709 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.91343e-10 2.805447e-10 1.311156e-10 ] [ 2.653002e-10 2.505168e-10 3.277079e-10 ] [ 1.829519e-10 4.618852000000001e-10 2.376516e-10 ] [ 4.982305e-10 1.900488e-10 2.423676e-10 ] [ 4.143762e-10 3.996307e-10 2.985709e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1022887 -0.6627417 -10.4714971 ] [ -4.8934651 -5.5214903 9.5183235 ] [ -0.8152794 1.5155627 -0.1456117 ] [ 0.8961291 -0.6037296 -0.3486711 ] [ 4.9149042 5.2723989 1.4474564 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.63884563712025e-10 -1.061829257369247e-09 -1.6777187838395e-08 ] [ -7.840195377920735e-09 -8.84640267063398e-09 1.525003538091123e-08 ] [ -1.306221594099852e-09 2.428199125296524e-09 -2.332956614549433e-10 ] [ 1.435757093238545e-09 -9.672814504049358e-10 -5.586326847686189e-10 ] [ 7.874544602711728e-09 8.447314253111638e-09 2.319080803707333e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.9189618 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.589192869856829e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.0173256 2.8392713 0.7198715 ] [ 2.4234402 2.2055984 3.7284283 ] [ 2.1556587 4.2114171 2.468417 ] [ 4.4531483 2.1190812 2.4812424 ] [ 4.4724452 4.450894 2.9761768 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0173256e-10 2.8392713e-10 7.198715e-11 ] [ 2.4234402e-10 2.2055984e-10 3.7284283e-10 ] [ 2.1556587e-10 4.2114171e-10 2.468417e-10 ] [ 4.4531483e-10 2.1190812e-10 2.4812424e-10 ] [ 4.4724452e-10 4.450894e-10 2.9761768e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5e-06 -2.94e-05 4.2e-06 ] [ 1.84e-05 -2.35e-05 5.7e-06 ] [ -3e-05 5.56e-05 -1.56e-05 ] [ -1.8e-06 1.16e-05 -1.3e-05 ] [ 8.3e-06 -1.43e-05 1.88e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.010883104e-15 -4.710399265152e-14 6.72914180736e-15 ] [ 2.948004982272e-14 -3.76511505888e-14 9.13240673856e-15 ] [ -4.8065298624e-14 8.908102011648e-14 -2.499395528448e-14 ] [ -2.88391791744e-15 1.858524880128e-14 -2.08282960704e-14 ] [ 1.329806595264e-14 -2.291112567744e-14 3.012092047104e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.103084 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.259563146597855e-18 } }