{ "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" [ [ -5.7855742 -0.8029711 1.0125428 ] [ -2.9618527 -0.1829438 0.4813657 ] [ 6.2085139 -12.7894619 11.183647 ] [ 0.6219247 11.0786662 -9.5282252 ] [ 1.9169883 2.6967106 -3.1493303 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.269511721143664e-09 -1.286501523598059e-09 1.622272401719371e-09 ] [ -4.745411150193357e-09 -2.93108279280311e-10 7.712328705950266e-10 ] [ 9.94713582049183e-09 -2.049097684879234e-08 1.791817775868006e-08 ] [ 9.964332142380537e-10 1.774997997528718e-08 -1.526589965315741e-08 ] [ 3.071353836607137e-09 4.32060667638354e-09 -5.045783377837051e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.1720691 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.14909214347821e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3681979 0.6620965 2.5721395 ] [ 0.3337874 2.4178247 0.8892364 ] [ 2.5423188 -0.3625086 2.6273501 ] [ 2.4571294 2.0505379 2.2202979 ] [ 2.4850392 2.5606699 -0.1744308 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.681979e-11 6.620965e-11 2.5721395e-10 ] [ 3.337874e-11 2.4178247e-10 8.892364000000001e-11 ] [ 2.5423188e-10 -3.625086e-11 2.6273501e-10 ] [ 2.4571294e-10 2.0505379e-10 2.2202979e-10 ] [ 2.4850392e-10 2.5606699e-10 -1.744308e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.15e-05 8.5e-06 -1.74e-05 ] [ -8.9e-06 7.9e-06 5e-07 ] [ 1.82e-05 -1.21e-05 8.5e-06 ] [ 1.09e-05 3.2e-06 5.3e-06 ] [ -8.8e-06 -7.6e-06 3.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.84250311392e-14 1.36185012768e-14 -2.787787320192e-14 ] [ -1.425937192512e-14 1.265719530432e-14 8.010883104e-16 ] [ 2.915961449856e-14 -1.938633711168e-14 1.36185012768e-14 ] [ 1.746372516672e-14 5.126965186560001e-15 8.491536090240001e-15 ] [ -1.409915426304e-14 -1.217654231808e-14 5.126965186560001e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.808346 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.21234091331172e-18 } }