{ "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" [ [ 0.4008083 0.5190667 2.588988 ] [ 0.3705603 2.591564 0.7446841 ] [ 2.694344 0.0700188 2.876141 ] [ 2.159519 1.331763 1.766469 ] [ 2.561241 2.816208 0.1583109 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.008083e-11 5.190667e-11 2.588988e-10 ] [ 3.705603e-11 2.591564e-10 7.446841e-11 ] [ 2.694344e-10 7.001880000000001e-12 2.876141e-10 ] [ 2.159519e-10 1.331763e-10 1.766469e-10 ] [ 2.561241e-10 2.816208e-10 1.583109e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.3241508 0.115196 0.0632789 ] [ -1.6239805 -0.4334794 0.6275279 ] [ 4.8346967 -6.4976188 5.5159349 ] [ -0.1438348 6.4755315 -5.5335226 ] [ 1.2572694 0.3403707 -0.673219 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.928053316573617e-09 1.845643380096768e-10 1.013839741699411e-10 ] [ -2.601903589735095e-09 -6.945105602784115e-10 1.00541053027972e-09 ] [ 7.746038021398912e-09 -1.041033293223055e-08 8.837501938634785e-09 ] [ -2.304487538174439e-10 1.037494517655396e-08 -8.86568054038843e-09 ] [ 2.014367638727243e-09 5.453339779453306e-10 -1.078615742478355e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.1140067 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.79571859415456e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.5710171 1.1934218 2.6486836 ] [ 0.0895864 1.9502447 0.5281147 ] [ 2.3625827 -0.4349876 2.3864123 ] [ 2.868404 1.9466506 2.3397833 ] [ 2.2948824 2.673291 0.2315991 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.710171000000001e-11 1.1934218e-10 2.6486836e-10 ] [ 8.95864e-12 1.9502447e-10 5.281147e-11 ] [ 2.3625827e-10 -4.349876e-11 2.3864123e-10 ] [ 2.868404e-10 1.9466506e-10 2.3397833e-10 ] [ 2.2948824e-10 2.673291e-10 2.315991e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.55e-05 1.35e-05 -1.28e-05 ] [ -4.1e-06 -9.7e-06 1.45e-05 ] [ 4.1e-06 -9e-06 -1.15e-05 ] [ 7e-06 1.87e-05 -7.9e-06 ] [ 8.6e-06 -1.36e-05 1.77e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.48337376224e-14 2.16293843808e-14 -2.050786074624e-14 ] [ -6.568924145279999e-15 -1.554111322176e-14 2.32315610016e-14 ] [ 6.568924145279999e-15 -1.44195895872e-14 -1.84250311392e-14 ] [ 1.12152363456e-14 2.996070280896e-14 -1.265719530432e-14 ] [ 1.377871893888e-14 -2.178960204288e-14 2.835852618816e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.457994 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.675555348726667e-18 } }