{ "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" [ [ 2.809505 0.8723329 1.807311 ] [ 2.882593 3.596674 1.603465 ] [ 4.93122 1.133464 0.704126 ] [ 5.052691 3.651911 0.4456494 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.809505e-10 8.723329e-11 1.807311e-10 ] [ 2.882593e-10 3.596674e-10 1.603465e-10 ] [ 4.93122e-10 1.133464e-10 7.041260000000001e-11 ] [ 5.052691000000001e-10 3.651911e-10 4.456494e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7732264 0.6469801 0.3570976 ] [ -0.8318832 -0.3618817 0.4574576 ] [ 1.1415639 0.1135773 -0.599251 ] [ 0.4635458 -0.3986756 -0.2153042 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.238845260665349e-09 1.036576390342846e-09 5.721334260637902e-10 ] [ -1.332823814276291e-09 -5.797983992353593e-10 7.329278717272782e-10 ] [ 1.828986991729269e-09 1.819708947135878e-10 -9.601059421910207e-10 ] [ 7.426822434300326e-10 -6.387487256034125e-10 -3.449553556000474e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -8.3838759 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.343244995866856e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8190609 1.045913 1.801527 ] [ 2.756633 3.5923062 1.6579276 ] [ 5.0813677 1.0348841 0.6223408 ] [ 5.0189474 3.5812785 0.478756 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8190609e-10 1.045913e-10 1.801527e-10 ] [ 2.756633e-10 3.5923062e-10 1.6579276e-10 ] [ 5.0813677e-10 1.0348841e-10 6.223408e-11 ] [ 5.0189474e-10 3.5812785e-10 4.78756e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.8e-06 7.7e-06 -3.6e-06 ] [ -9e-07 -1.8e-06 2.2e-06 ] [ 2.2e-06 2.4e-06 3e-07 ] [ -4.1e-06 -8.3e-06 1.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.48609453824e-15 1.233675998016e-14 -5.76783583488e-15 ] [ -1.44195895872e-15 -2.88391791744e-15 3.52478856576e-15 ] [ 3.52478856576e-15 3.84522388992e-15 4.8065298624e-16 ] [ -6.568924145279999e-15 -1.329806595264e-14 1.76239428288e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.6094174 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.379380727698872e-18 } }