{ "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" [ [ 1.291216 1.822107 1.800811 ] [ 1.534743 4.043561 0.7260553 ] [ 2.21799 3.847577 3.169656 ] [ 3.72216 2.8756 1.141297 ] [ 3.290513 5.175492 1.550965 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.291216e-10 1.822107e-10 1.800811e-10 ] [ 1.534743e-10 4.043561e-10 7.260553e-11 ] [ 2.21799e-10 3.847577e-10 3.169656e-10 ] [ 3.722160000000001e-10 2.8756e-10 1.141297e-10 ] [ 3.290513e-10 5.175492e-10 1.550965e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.9795902 2.5201594 -0.0029735 ] [ 0.0940315 -1.9901227 1.0899156 ] [ -0.0658294 -1.3848071 -2.7454025 ] [ -2.9972436 0.6836584 1.1619015 ] [ 0.9894513 0.171112 0.4965589 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.171653137204796e-09 4.037740471369355e-09 -4.7640721819488e-12 ] [ 1.506550709187552e-10 -3.188528062463372e-09 1.746237292965205e-09 ] [ -1.054703256412915e-10 -2.218705559937847e-09 -4.398619700185872e-09 ] [ -4.802113622762427e-09 1.095341505093535e-09 1.861571418972451e-09 ] [ 1.585275740280167e-09 2.741516459383296e-10 7.955750604301652e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -19.131117 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.065142838718943e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4499792 1.8982327 1.7992579 ] [ 1.5023139 4.0142059 0.7680762 ] [ 2.2113329 3.7670525 3.012215 ] [ 3.5203246 2.8773438 1.2529795 ] [ 3.3726714 5.2075022 1.5562557 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4499792e-10 1.8982327e-10 1.7992579e-10 ] [ 1.5023139e-10 4.0142059e-10 7.680762e-11 ] [ 2.2113329e-10 3.7670525e-10 3.012215e-10 ] [ 3.5203246e-10 2.8773438e-10 1.2529795e-10 ] [ 3.3726714e-10 5.2075022e-10 1.5562557e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.45e-05 -7.8e-06 -2.5e-06 ] [ 5.3e-06 4.1e-06 -3e-07 ] [ 3.9e-06 1.5e-05 1.04e-05 ] [ 1.96e-05 3.3e-06 -9.4e-06 ] [ -1.43e-05 -1.46e-05 1.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.32315610016e-14 -1.249697764224e-14 -4.005441552e-15 ] [ 8.491536090240001e-15 6.568924145279999e-15 -4.8065298624e-16 ] [ 6.24848882112e-15 2.4032649312e-14 1.666263685632e-14 ] [ 3.140266176767999e-14 5.28718284864e-15 -1.506046023552e-14 ] [ -2.291112567744e-14 -2.339177866368e-14 2.88391791744e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.398784 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.268245481754911e-18 } }