{ "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" [ [ 0.3142934 0.7540522 2.32218 ] [ 0.538251 2.820956 1.392978 ] [ 2.532298 0.1763292 2.432177 ] [ 1.796653 2.418536 0.8624239 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.142934e-11 7.540522e-11 2.32218e-10 ] [ 5.38251e-11 2.820956e-10 1.392978e-10 ] [ 2.532298e-10 1.763292e-11 2.432177e-10 ] [ 1.796653e-10 2.418536e-10 8.624239e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.3478 0.2298609 -0.5499889 ] [ -15.8492824 5.9628259 6.1729828 ] [ -0.3626061 0.0488646 -0.0786139 ] [ 14.8640885 -6.2415514 -5.5443801 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.15941364951424e-09 3.682777600160468e-10 -8.811793572795091e-10 ] [ -2.539334971773691e-08 9.55350025088072e-09 9.890208722760521e-09 ] [ -5.809590159794668e-10 7.828971970474369e-11 -1.259533526499091e-10 ] [ 2.381489508420214e-08 -1.000006773060151e-08 -8.883076173048767e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 6.88861548061204 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.103677867271757e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.353413 0.7406574 1.9546884 ] [ 0.3078929 3.0199421 1.8061381 ] [ 2.5609167 0.5510807 2.511703 ] [ 1.9592728 1.8581932 0.7372295 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.53413e-11 7.406574e-11 1.9546884e-10 ] [ 3.078929e-11 3.0199421e-10 1.8061381e-10 ] [ 2.5609167e-10 5.510807e-11 2.511703e-10 ] [ 1.9592728e-10 1.8581932e-10 7.372295e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.1e-06 -1.3e-06 3e-06 ] [ 8.1e-06 -7.6e-06 -4.2e-06 ] [ 5e-07 -2.1e-06 3.9e-06 ] [ -4.5e-06 1.09e-05 -2.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.568924145279999e-15 -2.08282960704e-15 4.8065298624e-15 ] [ 1.297763062848e-14 -1.217654231808e-14 -6.72914180736e-15 ] [ 8.010883104e-16 -3.36457090368e-15 6.24848882112e-15 ] [ -7.2097947936e-15 1.746372516672e-14 -4.32587687616e-15 ] ] } "relaxed-potential-energy" { "source-value" -3.8437085193879597 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.158299926933172e-19 } }