{ "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" [ [ 1.6079 1.726733 2.75301 ] [ 2.002918 3.986459 1.396167 ] [ 4.133267 4.619556 1.499098 ] [ 3.466505 3.469363 3.287809 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6079e-10 1.726733e-10 2.75301e-10 ] [ 2.002918e-10 3.986459e-10 1.396167e-10 ] [ 4.133267e-10 4.619556e-10 1.499098e-10 ] [ 3.466505e-10 3.469363e-10 3.287809000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.0411797 1.8532963 -0.4031451 ] [ -1.1056193 -1.3097265 0.5694242 ] [ 1.1658217 0.7235936 -0.6997843 ] [ -1.1013821 -1.2671635 0.5335051 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.668153773391558e-09 2.969308003275143e-09 -6.45909654010078e-10 ] [ -1.771397393965262e-09 -2.098413177942211e-09 9.123181405577435e-10 ] [ 1.867852271761311e-09 1.159324748880507e-09 -1.121178045062893e-09 ] [ -1.764608651187608e-09 -2.030219734431101e-09 8.54769398297566e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -8.9620994 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.435886613196571e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7657091 2.3022102 2.7483204 ] [ 1.8175989 3.7767826 0.9764085 ] [ 3.839584 4.5988487 1.7197245 ] [ 3.787698 3.1242694 3.4916306 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7657091e-10 2.3022102e-10 2.7483204e-10 ] [ 1.8175989e-10 3.7767826e-10 9.764085000000001e-11 ] [ 3.839584e-10 4.598848699999999e-10 1.7197245e-10 ] [ 3.787698e-10 3.1242694e-10 3.4916306e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.7e-06 -1.5e-06 1.8e-06 ] [ 5.1e-06 7.2e-06 -2e-06 ] [ -8.4e-06 -2.4e-06 -6.7e-06 ] [ 6e-07 -3.3e-06 6.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.32587687616e-15 -2.4032649312e-15 2.88391791744e-15 ] [ 8.17110076608e-15 1.153567166976e-14 -3.2043532416e-15 ] [ -1.345828361472e-14 -3.84522388992e-15 -1.073458335936e-14 ] [ 9.6130597248e-16 -5.28718284864e-15 1.105501868352e-14 ] ] } "relaxed-potential-energy" { "source-value" -9.6673908 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.548886752389701e-18 } }