{ "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" [ [ 0.2422976 0.2155702 0.7539187 ] [ 0.1069263 2.303076 0.5134626 ] [ 0.4438839 2.233015 2.726304 ] [ 2.36111 0.1695128 0.2725886 ] [ 2.483594 1.001172 2.982027 ] [ 2.63043 2.516837 1.068712 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.422976e-11 2.155702e-11 7.539187e-11 ] [ 1.069263e-11 2.303076e-10 5.134626e-11 ] [ 4.438839e-11 2.233015e-10 2.726304e-10 ] [ 2.36111e-10 1.695128e-11 2.725886e-11 ] [ 2.483594e-10 1.001172e-10 2.982027e-10 ] [ 2.63043e-10 2.516837e-10 1.068712e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.3974508 -2.4480141 1.0351606 ] [ 0.5586178 2.8143318 -1.2238191 ] [ 0.5735791 -0.4075855 0.7531849 ] [ 1.7586663 0.9412312 0.666125 ] [ -0.3702827 0.1031792 -1.239316 ] [ -1.1231296 -1.0031426 0.0086645 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.238963000478257e-09 -3.922150958408754e-09 1.6585101120933e-09 ] [ 8.950043791227304e-10 4.509056613133982e-09 -1.960774350108497e-09 ] [ 9.189750241995053e-10 -6.530239590770783e-10 1.206735237919586e-09 ] [ 2.817694029648839e-09 1.508018623407529e-09 1.0672499015304e-09 ] [ -5.932582850267002e-10 1.653113019928474e-10 -1.985603120983373e-09 ] [ -1.799451987248455e-09 -1.607211621048526e-09 1.38820593309216e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -19.114052 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.062408724315549e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.2321101 0.0919103 1.4287246 ] [ 0.4449601 2.1792505 0.1309971 ] [ 0.4510016 2.2538022 2.5969244 ] [ 2.3050764 0.559261 0.1754101 ] [ 2.3111238 0.6338073 2.641337 ] [ 2.5239696 2.7211517 1.3436197 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.321101e-11 9.191030000000001e-12 1.4287246e-10 ] [ 4.449601000000001e-11 2.1792505e-10 1.309971e-11 ] [ 4.510016e-11 2.2538022e-10 2.5969244e-10 ] [ 2.3050764e-10 5.592610000000001e-11 1.754101e-11 ] [ 2.3111238e-10 6.338073e-11 2.641337e-10 ] [ 2.5239696e-10 2.7211517e-10 1.3436197e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 -6.2e-06 -9.5e-06 ] [ -9.9e-06 8.8e-06 -1.4e-06 ] [ 8.7e-06 -4.7e-06 2.7e-06 ] [ 1.8e-06 -4e-06 7.6e-06 ] [ -3.9e-06 4.4e-06 7e-06 ] [ 3.3e-06 1.6e-06 -6.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 -9.93349504896e-15 -1.52206778976e-14 ] [ -1.586154854592e-14 1.409915426304e-14 -2.24304726912e-15 ] [ 1.393893660096e-14 -7.53023011776e-15 4.32587687616e-15 ] [ 2.88391791744e-15 -6.4087064832e-15 1.217654231808e-14 ] [ -6.24848882112e-15 7.04957713152e-15 1.12152363456e-14 ] [ 5.28718284864e-15 2.56348259328e-15 -1.025393037312e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.568499 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.295436822274818e-18 } }