{ "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" [ [ 2.146488 0.2959799 2.352543 ] [ 2.393537 2.53814 1.109639 ] [ 1.99319 1.640865 4.12466 ] [ 3.097066 3.51077 3.500726 ] [ 3.970578 1.750203 2.795194 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.146488e-10 2.959799e-11 2.352543e-10 ] [ 2.393537e-10 2.53814e-10 1.109639e-10 ] [ 1.99319e-10 1.640865e-10 4.12466e-10 ] [ 3.097066e-10 3.51077e-10 3.500726e-10 ] [ 3.970578e-10 1.750203e-10 2.795194e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.8615038 -19.5279328 -19.2573585 ] [ -1.928897 1.7526175 -4.7617444 ] [ -27.5491902 6.9220505 36.4791033 ] [ -20.2074475 54.536092 18.8038999 ] [ 53.5470385 -43.6828272 -31.2639002 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.186811109490359e-09 -3.128719738471348e-08 -3.085368956706416e-08 ] [ -3.090433677331258e-09 2.808002783704944e-09 -7.629155551905324e-09 ] [ -4.413866846041248e-08 1.109034747909695e-08 5.844596645500813e-08 ] [ -3.237589995054341e-08 8.737645159219792e-08 3.012716879964346e-08 ] [ 8.57918131977775e-08 -6.998760447028632e-08 -5.009028997546444e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 1.2046277 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.930026337708076e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.8923025 0.3548276 2.1724172 ] [ 2.5463735 2.6047787 1.0092796 ] [ 2.1115522 1.5013855 4.5134201 ] [ 2.7658622 3.7512696 3.3502961 ] [ 4.2847687 1.5236966 2.8373489 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8923025e-10 3.548276e-11 2.1724172e-10 ] [ 2.5463735e-10 2.6047787e-10 1.0092796e-10 ] [ 2.1115522e-10 1.5013855e-10 4.5134201e-10 ] [ 2.7658622e-10 3.7512696e-10 3.3502961e-10 ] [ 4.2847687e-10 1.5236966e-10 2.8373489e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.56e-05 -2.4e-05 -3.83e-05 ] [ 5.4e-05 -2.34e-05 1.11e-05 ] [ 3.69e-05 -3.18e-05 4.78e-05 ] [ -1.78e-05 7.1e-05 -6.2e-06 ] [ -3.75e-05 8.2e-06 -1.45e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.703748770048e-14 -3.84522388992e-14 -6.136336457664001e-14 ] [ 8.65175375232e-14 -3.749093292672001e-14 1.778416049088e-14 ] [ 5.912031730752001e-14 -5.094921654144e-14 7.658404247424001e-14 ] [ -2.851874385024e-14 1.137545400768e-13 -9.93349504896e-15 ] [ -6.008162327999999e-14 1.313784829056e-14 -2.32315610016e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.806069 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.692629083935164e-18 } }