{ "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" [ [ 0.0317926 0.0463887 1.270674 ] [ 0.0111454 2.887791 2.968384 ] [ 2.5478 0.1715431 0.0845133 ] [ 1.93577 0.0052704 2.481441 ] [ 2.875434 2.93696 0.1676441 ] [ 2.282488 2.689422 2.770272 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.17926e-12 4.63887e-12 1.270674e-10 ] [ 1.11454e-12 2.887791e-10 2.968384e-10 ] [ 2.5478e-10 1.715431e-11 8.451330000000001e-12 ] [ 1.93577e-10 5.270399999999999e-13 2.481441e-10 ] [ 2.875434e-10 2.93696e-10 1.676441e-11 ] [ 2.282488e-10 2.689422e-10 2.770272e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.9330162 0.8893261 -0.3726414 ] [ -0.7302124 -0.8151289 -0.5115103 ] [ 0.5431412 2.4005183 -0.3873964 ] [ 1.9374128 2.0993711 1.5522819 ] [ -0.6836515 -2.5833045 1.9487617 ] [ 0.866326 -1.9907821 -2.2294956 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.097033363267657e-09 1.424857485687243e-09 -5.970373390221812e-10 ] [ -1.169929235498258e-09 -1.305980466518421e-09 -8.195298439583942e-10 ] [ 8.702081324332569e-10 3.84605429806256e-09 -6.206774550620851e-10 ] [ 3.104077492998666e-09 3.363563294803179e-09 2.487029769071004e-09 ] [ -1.095330450074851e-09 -4.138910074307434e-09 3.122260435250463e-09 ] [ 1.388007263191181e-09 -3.189584537727128e-09 -3.572045726496468e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.958801 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.755793475419966e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.0157654 0.3669038 1.4482171 ] [ -0.0700315 2.5193547 2.4747712 ] [ 2.1221755 0.4693582 0.0301035 ] [ 2.3571237 0.1512255 2.6331556 ] [ 2.9598945 2.6667862 0.4347679 ] [ 2.2995024 2.5637468 2.721913 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.57654e-12 3.669038e-11 1.4482171e-10 ] [ -7.00315e-12 2.5193547e-10 2.474771200000001e-10 ] [ 2.1221755e-10 4.693582e-11 3.01035e-12 ] [ 2.3571237e-10 1.512255e-11 2.6331556e-10 ] [ 2.9598945e-10 2.6667862e-10 4.347679e-11 ] [ 2.2995024e-10 2.5637468e-10 2.721913e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.53e-05 7e-06 1.73e-05 ] [ -1.27e-05 6.3e-06 -2.07e-05 ] [ -2.87e-05 1.05e-05 -1.07e-05 ] [ 6.8e-06 1.1e-06 1.06e-05 ] [ 5.4e-06 -1e-07 1.56e-05 ] [ -6.1e-06 -2.49e-05 -1.22e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.655683471424e-14 1.12152363456e-14 2.771765553984e-14 ] [ -2.034764308416e-14 1.009371271104e-14 -3.316505605055999e-14 ] [ -4.598246901696e-14 1.68228545184e-14 -1.714328984256e-14 ] [ 1.089480102144e-14 1.76239428288e-15 1.698307218048e-14 ] [ 8.65175375232e-15 -1.6021766208e-16 2.499395528448e-14 ] [ -9.77327738688e-15 -3.989419785791999e-14 -1.954655477376e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.165535 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.269568899812413e-18 } }