{ "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" [ [ 1.593193 1.569284 2.84459 ] [ 1.603337 4.216737 3.188357 ] [ 3.675145 1.205287 1.773064 ] [ 3.545696 2.526378 4.008338 ] [ 3.206595 3.44318 2.117333 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.593193e-10 1.569284e-10 2.84459e-10 ] [ 1.603337e-10 4.216737e-10 3.188357e-10 ] [ 3.675145e-10 1.205287e-10 1.773064e-10 ] [ 3.545696e-10 2.526378e-10 4.008338e-10 ] [ 3.206595e-10 3.44318e-10 2.117333e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.259301 -8.0749929 1.9990057 ] [ -11.9085448 9.2281502 4.2971744 ] [ 2.7367674 -6.2816229 -7.9514316 ] [ 5.5195887 -0.6183389 13.4907779 ] [ 11.9114896 5.7468044 -11.8355264 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.323285896635006e-08 -1.293756483750599e-08 3.202760197385939e-09 ] [ -1.907959206630941e-08 1.478512650367084e-08 6.884832359180268e-09 ] [ 4.384784744847602e-09 -1.00642693510619e-08 -1.273959781141034e-08 ] [ 8.843355971571865e-09 -9.906881293111893e-10 2.161460894778532e-08 ] [ 1.908431015602234e-08 9.207395653990571e-09 -1.896260369294119e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -4.1312914 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.619058494792102e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.7634794 1.446108 2.1433242 ] [ 1.228742 3.8231891 3.0445827 ] [ 3.2739528 1.1208592 1.6227694 ] [ 4.7391641 3.1559182 4.6124117 ] [ 3.6186278 3.4147915 2.508594 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.634794e-11 1.446108e-10 2.1433242e-10 ] [ 1.228742e-10 3.8231891e-10 3.0445827e-10 ] [ 3.2739528e-10 1.1208592e-10 1.6227694e-10 ] [ 4.7391641e-10 3.1559182e-10 4.6124117e-10 ] [ 3.6186278e-10 3.4147915e-10 2.508594e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8.1e-06 1.08e-05 4e-06 ] [ 1.44e-05 -1.32e-05 -4.5e-06 ] [ -8.8e-06 -1.6e-06 -8.3e-06 ] [ -1.59e-05 1.16e-05 -2.06e-05 ] [ 2.2e-06 -7.6e-06 2.94e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.297763062848e-14 1.730350750464e-14 6.4087064832e-15 ] [ 2.307134333952e-14 -2.114873139456e-14 -7.2097947936e-15 ] [ -1.409915426304e-14 -2.56348259328e-15 -1.329806595264e-14 ] [ -2.547460827072e-14 1.858524880128e-14 -3.300483838848e-14 ] [ 3.52478856576e-15 -1.217654231808e-14 4.710399265152e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.90107 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.227196935810426e-18 } }