{ "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" [ [ 0.7481215 0.3697243 2.264709 ] [ 0.2413431 2.204484 1.035234 ] [ 2.632044 0.6504598 2.339521 ] [ 2.588426 1.874203 0.0457334 ] [ 2.842468 2.848588 2.160611 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.481215e-11 3.697243e-11 2.264709e-10 ] [ 2.413431e-11 2.204484e-10 1.035234e-10 ] [ 2.632044e-10 6.504598e-11 2.339521e-10 ] [ 2.588426e-10 1.874203e-10 4.57334e-12 ] [ 2.842468e-10 2.848588e-10 2.160611e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.1491006 -2.0786888 -0.5151862 ] [ -0.9336318 0.3746521 -0.362336 ] [ 10.1776436 -0.5319366 1.660751 ] [ 0.0001603 0.4063832 -0.5618451 ] [ 0.9049285 1.82959 -0.2213837 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.626065183743538e-08 -3.330426624717499e-09 -8.254192917992507e-10 ] [ -1.495843054719361e-09 6.002588404990314e-10 -5.805262728570239e-10 ] [ 1.630638276509964e-08 -8.522563912894043e-10 2.660816447092134e-09 ] [ 2.568289144302e-13 6.510976674901488e-10 -9.001750911473933e-10 ] [ 1.449855298140669e-09 2.93132634780006e-09 -3.546957912884657e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -7.0221059 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.125065399445354e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3160169 0.3839984 2.57064 ] [ -1.0474409 1.3816341 1.0170917 ] [ 2.5417114 0.8183986 2.9248153 ] [ 3.3455274 3.1963996 -0.3213664 ] [ 3.8965878 2.1670285 1.6546278 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.160169e-11 3.839984e-11 2.57064e-10 ] [ -1.0474409e-10 1.3816341e-10 1.0170917e-10 ] [ 2.5417114e-10 8.183986e-11 2.9248153e-10 ] [ 3.3455274e-10 3.1963996e-10 -3.213664e-11 ] [ 3.8965878e-10 2.1670285e-10 1.6546278e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.8e-06 -2.41e-05 2.14e-05 ] [ 4e-06 2.57e-05 -2.57e-05 ] [ 1.34e-05 1.38e-05 -1.26e-05 ] [ -1.96e-05 -2e-05 1.91e-05 ] [ -1.6e-06 4.6e-06 -2.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.088271209199999e-15 -3.86124568794e-14 3.42865799676e-14 ] [ 6.408706535999999e-15 4.11759394938e-14 -4.11759394938e-14 ] [ 2.14691668956e-14 2.21100375492e-14 -2.01874255884e-14 ] [ -3.140266202639999e-14 -3.204353268e-14 3.06015737094e-14 ] [ -2.5634826144e-15 7.370012516399999e-15 -3.685006258199999e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.663724 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.708516942422502e-18 } }