{ "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" [ [ 0.0409622 2.87289 0.6143003 ] [ 0.4467191 2.12103 2.019138 ] [ 1.9155 0.4332474 1.113336 ] [ 2.832667 2.287938 0.2396185 ] [ 2.613397 2.701371 2.225579 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.09622e-12 2.87289e-10 6.143003e-11 ] [ 4.467191e-11 2.12103e-10 2.019138e-10 ] [ 1.9155e-10 4.332474e-11 1.113336e-10 ] [ 2.832667e-10 2.287938e-10 2.396185e-11 ] [ 2.613397e-10 2.701371e-10 2.225579e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.4720006 9.315035 -15.4151762 ] [ -3.588291 -6.9537062 16.9137927 ] [ 0.111728 -9.1618878 -1.1836017 ] [ 6.187219 1.4581772 -8.4559864 ] [ 5.7613445 5.3423818 8.1409716 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.357364129272357e-08 1.492433129893373e-08 -2.469783491315258e-08 ] [ -5.749075948827053e-09 -1.114106550155201e-08 2.709888323299771e-08 ] [ 1.790079894887424e-10 -1.467896243555275e-08 -1.896338972079136e-09 ] [ 9.913017629569556e-09 2.336257418823606e-09 -1.354798371588276e-08 ] [ 9.230691462274666e-09 8.559439219347422e-09 1.304327436811677e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 1.1564839 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.852891466911605e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.2574836 3.0192458 0.2393967 ] [ 0.4745668 1.8259152 2.4353325 ] [ 1.7727002 0.2083247 1.0241103 ] [ 2.6651329 2.3406755 0.0494544 ] [ 2.6793618 3.0223152 2.4636779 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.574836e-11 3.0192458e-10 2.393967e-11 ] [ 4.745668e-11 1.8259152e-10 2.4353325e-10 ] [ 1.7727002e-10 2.083247e-11 1.0241103e-10 ] [ 2.6651329e-10 2.3406755e-10 4.945440000000001e-12 ] [ 2.6793618e-10 3.0223152e-10 2.4636779e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.2e-06 0.0 -4e-06 ] [ 7e-07 -4e-07 -8e-07 ] [ 2.7e-06 2.1e-06 -3.3e-06 ] [ -1.05e-05 -2.4e-06 1.12e-05 ] [ 3.9e-06 6e-07 -3.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.126965186560001e-15 0.0 -6.4087064832e-15 ] [ 1.12152363456e-15 -6.408706483200001e-16 -1.28174129664e-15 ] [ 4.32587687616e-15 3.36457090368e-15 -5.28718284864e-15 ] [ -1.68228545184e-14 -3.84522388992e-15 1.794437815296e-14 ] [ 6.24848882112e-15 9.6130597248e-16 -4.96674752448e-15 ] ] } "relaxed-potential-energy" { "source-value" -6.9990301 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.121368239449549e-18 } }