{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.689863 2.613928 1.941703 ] [ 2.080356 5.103994 1.950756 ] [ 1.651882 3.89841 3.770183 ] [ 3.604737 2.326315 3.946353 ] [ 4.359532 3.977463 2.369793 ] [ 3.455978 5.487629 3.928773 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.689863e-10 2.613928e-10 1.941703e-10 ] [ 2.080356e-10 5.103994e-10 1.950756e-10 ] [ 1.651882e-10 3.89841e-10 3.770183e-10 ] [ 3.604737e-10 2.326315e-10 3.946353e-10 ] [ 4.359532e-10 3.977463000000001e-10 2.369793e-10 ] [ 3.455978e-10 5.487629000000001e-10 3.928773e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.748039 -6.6812855 -8.6361807 ] [ -4.8138036 7.5096607 -9.6680382 ] [ -6.4084509 -3.2772427 6.6846691 ] [ 3.1268003 -7.1752192 10.2643791 ] [ 11.5282676 4.9752042 -3.7113992 ] [ 3.3152255 4.6488825 5.0665698 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.081155041112073e-08 -1.070459951318301e-08 -1.383668692454176e-08 ] [ -7.712563648585081e-09 1.203180290280808e-08 -1.548990490065941e-08 ] [ -1.026747029211627e-08 -5.250721677887071e-09 1.071002063804181e-08 ] [ 5.009686379844189e-09 -1.149596854606817e-08 1.644534835653795e-08 ] [ 1.847032097921925e-08 7.971155918618662e-09 -5.946317077686292e-09 ] [ 5.311576832540966e-09 7.448330915711504e-09 8.117539748090052e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.9707963 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.566270318233653e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.4462065 3.146559 0.3325083 ] [ 0.2896359 4.6890332 3.2226924 ] [ 2.4444458 3.9067307 2.5867759 ] [ 3.2880062 2.1904875 4.1321566 ] [ 5.1882778 3.8785206 4.6491177 ] [ 4.1857758 5.596408 2.9843101 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4462065e-10 3.146559e-10 3.325083e-11 ] [ 2.896359e-11 4.6890332e-10 3.2226924e-10 ] [ 2.4444458e-10 3.9067307e-10 2.5867759e-10 ] [ 3.2880062e-10 2.1904875e-10 4.1321566e-10 ] [ 5.1882778e-10 3.8785206e-10 4.6491177e-10 ] [ 4.1857758e-10 5.596408000000001e-10 2.9843101e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.7e-06 -5.2e-06 -3e-06 ] [ 2.8e-06 1.1e-06 -0.0 ] [ -1e-06 -9.9e-06 -5.2e-06 ] [ 8e-07 1.1e-05 -8.4e-06 ] [ 3.4e-06 -5e-07 8.7e-06 ] [ 2.6e-06 3.5e-06 8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.39389367158e-14 -8.331318496799998e-15 -4.806529901999999e-15 ] [ 4.486094575199999e-15 1.7623942974e-15 0.0 ] [ -1.602176634e-15 -1.58615486766e-14 -8.331318496799998e-15 ] [ 1.2817413072e-15 1.7623942974e-14 -1.34582837256e-14 ] [ 5.4474005556e-15 -8.010883169999999e-16 1.39389367158e-14 ] [ 4.165659248399999e-15 5.607618218999999e-15 1.2817413072e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.408087 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.789083023403915e-18 } }