{ "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" [ [ 0.1139215 0.7675217 1.173379 ] [ 0.3197986 0.4128002 2.663942 ] [ 1.547269 0.0076724 0.5415715 ] [ 1.777725 2.329132 1.457723 ] [ 2.606996 1.505358 2.342036 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.139215e-11 7.675217e-11 1.173379e-10 ] [ 3.197986e-11 4.128002e-11 2.663942e-10 ] [ 1.547269e-10 7.672400000000001e-13 5.415715e-11 ] [ 1.777725e-10 2.329132e-10 1.457723e-10 ] [ 2.606996e-10 1.505358e-10 2.342036e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -27.4947472 24.1286097 -37.7156377 ] [ 4.8426891 -12.28508 48.2181691 ] [ 21.7128042 -12.7930013 -10.8048498 ] [ -32.6981681 31.304869 -34.1498579 ] [ 33.637422 -30.3553973 34.4521763 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.405144152157692e-08 3.865829467224574e-08 -6.042711345934949e-08 ] [ 7.758843321746489e-09 -1.968286812282072e-08 7.72540238662808e-08 ] [ 3.478774754785706e-08 -2.049664776159162e-08 -1.731127788343957e-08 ] [ -5.238824090442416e-08 5.015592964223094e-08 -5.47141043818003e-08 ] [ 5.389309155639755e-08 -4.863470826984669e-08 5.519847185830857e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 25.328098 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.058008679926213e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.6331741 0.56943 1.3600065 ] [ -0.9286465 -0.0206267 2.9414104 ] [ 0.9797678 -0.7766852 -0.4719689 ] [ 1.8484539 2.5055641 1.6106163 ] [ 3.8329608 2.7448022 2.7385872 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.331741e-11 5.6943e-11 1.3600065e-10 ] [ -9.286465000000001e-11 -2.06267e-12 2.9414104e-10 ] [ 9.797678e-11 -7.766852e-11 -4.719689e-11 ] [ 1.8484539e-10 2.5055641e-10 1.6106163e-10 ] [ 3.8329608e-10 2.7448022e-10 2.7385872e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.7e-06 -3.42e-05 1.78e-05 ] [ 1.47e-05 1.81e-05 -1.55e-05 ] [ -9e-07 2.2e-05 1.01e-05 ] [ -1.57e-05 7.9e-06 -1.11e-05 ] [ -7.8e-06 -1.38e-05 -1.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.55411133498e-14 -5.479444088279999e-14 2.851874408519999e-14 ] [ 2.35519965198e-14 2.899939707539999e-14 -2.4833737827e-14 ] [ -1.4419589706e-15 3.5247885948e-14 1.61819840034e-14 ] [ -2.515417315379999e-14 1.26571954086e-14 -1.77841606374e-14 ] [ -1.24969777452e-14 -2.21100375492e-14 -2.0828296242e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.575945 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.694453196146913e-18 } }