{ "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" [ [ 0.4930526 2.627539 0.7125628 ] [ 1.672692 0.3562933 1.820781 ] [ 2.564645 2.142481 0.5360326 ] [ 2.257943 2.547137 2.334879 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.930526e-11 2.627539e-10 7.125628e-11 ] [ 1.672692e-10 3.562933e-11 1.820781e-10 ] [ 2.564645e-10 2.142481e-10 5.360326e-11 ] [ 2.257943e-10 2.547137e-10 2.334879e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.5276435 0.3709756 0.1842204 ] [ -0.9192275 -1.0288219 -0.2263756 ] [ 7.0900601 -3.8035976 -15.4659715 ] [ -1.6431891 4.4614439 15.5081267 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.254084622781978e-09 5.943684381041303e-10 2.951536203861336e-10 ] [ -1.472764821830235e-09 -1.648354408727485e-09 -3.626936968277304e-10 ] [ 1.13595286258757e-08 -6.094035199858478e-09 -2.477921815940993e-08 ] [ -2.632679181263489e-09 7.148021170481832e-09 2.484675823585153e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -6.5513311 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.049638961001752e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4437925 2.4892835 0.8618813 ] [ 1.5579445 0.468323 1.7052279 ] [ 2.7851974 2.0389874 0.2686648 ] [ 2.2013982 2.6768565 2.5684813 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.437925e-11 2.4892835e-10 8.618813e-11 ] [ 1.5579445e-10 4.68323e-11 1.7052279e-10 ] [ 2.7851974e-10 2.0389874e-10 2.686648e-11 ] [ 2.2013982e-10 2.6768565e-10 2.5684813e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.6e-06 9e-07 -5.1e-06 ] [ 3.6e-06 9.8e-06 5.1e-06 ] [ 7e-07 1.4e-06 4.6e-06 ] [ 3.3e-06 -1.21e-05 -4.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.21765424184e-14 1.4419589706e-15 -8.1711008334e-15 ] [ 5.767835882399999e-15 1.57013310132e-14 8.1711008334e-15 ] [ 1.1215236438e-15 2.2430472876e-15 7.370012516399999e-15 ] [ 5.2871828922e-15 -1.93863372714e-14 -7.370012516399999e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.513855 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.684505281426407e-18 } }