{ "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" [ [ 0.0417064 1.393533 2.342657 ] [ 0.9221083 2.569653 0.2410471 ] [ 1.810038 0.5140043 0.5075901 ] [ 2.608454 2.928842 0.8878785 ] [ 2.606177 1.867368 2.693771 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.17064e-12 1.393533e-10 2.342657e-10 ] [ 9.221083e-11 2.569653e-10 2.410471e-11 ] [ 1.810038e-10 5.140043e-11 5.075901e-11 ] [ 2.608454e-10 2.928842e-10 8.878785000000001e-11 ] [ 2.606177e-10 1.867368e-10 2.693771e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.7412177 -1.9830618 8.6270116 ] [ -22.3180363 9.1800862 -18.9564459 ] [ 1.2631138 -24.7383064 -11.4351188 ] [ 20.4041183 19.4084537 -0.8124278 ] [ 11.3920219 -1.8671717 22.576981 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.720932787786315e-08 -3.177215253561566e-09 1.38219962928904e-08 ] [ -3.575743598202574e-08 1.470811948656871e-08 -3.037157443444001e-08 ] [ 2.023731399769847e-09 -3.963513615226701e-08 -1.832107999743055e-08 ] [ 3.269100130829744e-08 3.109577076401925e-08 -1.301652827247978e-09 ] [ 1.825203115182159e-08 -2.991538844759392e-09 3.61723111264458e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 6.2989428 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.009201888991649e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3023163 1.5455969 2.634909 ] [ 0.9163636 2.0305593 0.3259638 ] [ 1.4273606 0.0228486 -0.7868661 ] [ 2.9780371 3.0800814 1.0950379 ] [ 2.364406 2.5943141 3.4038991 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.023163e-11 1.5455969e-10 2.634909e-10 ] [ 9.163636e-11 2.0305593e-10 3.259638000000001e-11 ] [ 1.4273606e-10 2.28486e-12 -7.868661000000001e-11 ] [ 2.9780371e-10 3.0800814e-10 1.0950379e-10 ] [ 2.364406e-10 2.5943141e-10 3.4038991e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.01e-05 5e-06 -6.9e-06 ] [ 2.86e-05 5.08e-05 2.5e-05 ] [ -1.67e-05 -3.41e-05 -5.1e-06 ] [ -3.41e-05 -1.83e-05 3.91e-05 ] [ -4.79e-05 -3.3e-06 -5.21e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.1231258111808e-13 8.010883104e-15 -1.105501868352e-14 ] [ 4.582225135488e-14 8.139057233664001e-14 4.005441552e-14 ] [ -2.675634956736e-14 -5.463422276928e-14 -8.17110076608e-15 ] [ -5.463422276928e-14 -2.931983216064e-14 6.264510587328001e-14 ] [ -7.674426013632e-14 -5.28718284864e-15 -8.347340194367999e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.419499 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.669387769824898e-18 } }