{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.061869 2.942366 1.677644 ] [ 1.882152 2.580028 5.41738 ] [ 1.143094 3.952812 3.395101 ] [ 3.99886 1.876175 2.533949 ] [ 4.004626 1.895608 4.810911 ] [ 3.218518 3.766044 3.544324 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.061869e-10 2.942366e-10 1.677644e-10 ] [ 1.882152e-10 2.580028e-10 5.41738e-10 ] [ 1.143094e-10 3.952812e-10 3.395101e-10 ] [ 3.99886e-10 1.876175e-10 2.533949e-10 ] [ 4.004626e-10 1.895608e-10 4.810911e-10 ] [ 3.218518e-10 3.766044e-10 3.544324e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1734491 -1.480949 -2.3385268 ] [ -0.4956496 0.3738787 -0.670779 ] [ -3.8890257 0.5897643 2.0035019 ] [ 0.2942352 -0.9145349 -1.2594535 ] [ 0.0670614 -0.3033955 0.8338411 ] [ 3.8499298 1.7352363 1.4314164 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.778960929188012e-10 -2.372741864397139e-09 -3.746732966074237e-09 ] [ -7.941182012288717e-10 5.99019712155097e-10 -1.074706431523603e-09 ] [ -6.230906054230355e-09 9.449065732424775e-10 3.20996390390838e-09 ] [ 4.714167584564121e-10 -1.465246435685666e-09 -2.017866952684733e-09 ] [ 1.074442072381171e-10 -4.860931769559264e-10 1.335960715882155e-09 ] [ 6.16826751728122e-09 2.780155031423495e-09 2.293381890709701e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.8487219304906795 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.37068553859241e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.8079206 2.8146216 2.1562575 ] [ 1.6995188 1.6892892 4.2392825 ] [ 1.7474699 4.0579255 4.1731013 ] [ 3.6889031 1.6130855 2.953335 ] [ 3.6284525 2.8563894 4.9701789 ] [ 3.7368541 3.9817218 2.8871538 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8079206e-10 2.8146216e-10 2.1562575e-10 ] [ 1.6995188e-10 1.6892892e-10 4.2392825e-10 ] [ 1.7474699e-10 4.0579255e-10 4.1731013e-10 ] [ 3.6889031e-10 1.6130855e-10 2.953335e-10 ] [ 3.6284525e-10 2.8563894e-10 4.9701789e-10 ] [ 3.7368541e-10 3.9817218e-10 2.8871538e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.3e-06 1e-07 -4e-06 ] [ -1.3e-06 -2.4e-06 1.6e-06 ] [ -2.4e-06 2.7e-06 1.3e-06 ] [ 2.2e-06 -2.3e-06 4e-07 ] [ 1.9e-06 -9e-07 1.9e-06 ] [ 3e-06 2.8e-06 -1.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.28718284864e-15 1.6021766208e-16 -6.4087064832e-15 ] [ -2.08282960704e-15 -3.84522388992e-15 2.56348259328e-15 ] [ -3.84522388992e-15 4.32587687616e-15 2.08282960704e-15 ] [ 3.52478856576e-15 -3.68500622784e-15 6.408706483200001e-16 ] [ 3.04413557952e-15 -1.44195895872e-15 3.04413557952e-15 ] [ 4.8065298624e-15 4.48609453824e-15 -1.92261194496e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.32264193049068 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.333434232432195e-18 } }