{ "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" [ [ 0.635409 0.2945373 0.4894103 ] [ 0.6913641 0.4672635 2.355287 ] [ 2.952385 0.4157679 2.192681 ] [ 2.385934 1.774442 0.4759126 ] [ 2.093707 2.943435 1.550224 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.35409e-11 2.945373e-11 4.894103e-11 ] [ 6.913641e-11 4.672635e-11 2.355287e-10 ] [ 2.952385e-10 4.157679e-11 2.192681e-10 ] [ 2.385934000000001e-10 1.774442e-10 4.759126e-11 ] [ 2.093707e-10 2.943435e-10 1.550224e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2547737 -0.7377126 -3.6059415 ] [ -2.547074 2.1203481 5.3688053 ] [ 2.9225038 -0.9527325 1.2152463 ] [ 10.6096364 -25.4706354 -30.8427376 ] [ -9.7302925 25.0407324 27.8646274 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.010369103097726e-09 -1.181945890327388e-09 -5.777355214870911e-09 ] [ -4.080862447868916e-09 3.397172181766295e-09 8.601774404155359e-09 ] [ 4.682367301136208e-09 -1.526445749952405e-09 1.947039226414954e-09 ] [ 1.699851153531587e-08 -4.080845689101324e-08 -4.941551351131324e-08 ] [ -1.558964728548544e-08 4.011967634952674e-08 4.464405493539617e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -2.4470793 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.920653276005076e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.5155682 0.2576638 0.4701555 ] [ 0.6914104 0.7866712 2.3126593 ] [ 3.2525448 0.1130063 2.2948097 ] [ 2.5390214 1.7654991 0.3522417 ] [ 1.7602543 2.9726054 1.6336488 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.155682000000001e-11 2.576638e-11 4.701555e-11 ] [ 6.914104e-11 7.866712e-11 2.3126593e-10 ] [ 3.2525448e-10 1.130063e-11 2.2948097e-10 ] [ 2.5390214e-10 1.7654991e-10 3.522417e-11 ] [ 1.7602543e-10 2.9726054e-10 1.6336488e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.8e-06 4.24e-05 5.19e-05 ] [ 1.6e-06 -4.93e-05 -3.8e-05 ] [ 1.5e-05 -4.07e-05 4.83e-05 ] [ -3.44e-05 7.84e-05 1.18e-05 ] [ 1.97e-05 -3.08e-05 -7.4e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.8839179412e-15 6.79322892816e-14 8.315296730459999e-14 ] [ 2.5634826144e-15 -7.89873080562e-14 -6.088271209199999e-14 ] [ 2.403264951e-14 -6.520858900379999e-14 7.73851314222e-14 ] [ -5.51148762096e-14 1.256106481056e-13 1.89056842812e-14 ] [ 3.15628796898e-14 -4.93470403272e-14 -1.18561070916e-13 ] ] } "relaxed-potential-energy" { "source-value" -11.088346 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.776548887090736e-18 } }