{ "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" [ [ 0.7955699 1.924478 0.0578634 ] [ 0.2789322 2.342777 2.34838 ] [ 2.533834 0.6960937 0.5593318 ] [ 1.694509 0.4311754 2.932881 ] [ 2.816233 2.726519 1.407602 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.955699e-11 1.924478e-10 5.786340000000001e-12 ] [ 2.789322e-11 2.342777e-10 2.34838e-10 ] [ 2.533834e-10 6.960937e-11 5.593318000000001e-11 ] [ 1.694509e-10 4.311754e-11 2.932881e-10 ] [ 2.816233e-10 2.726519e-10 1.407602e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.5429177 1.3639226 -2.260178 ] [ -0.3132959 0.1476931 0.8499173 ] [ 2.3452669 -4.6129831 -0.3495972 ] [ 0.0239013 0.0239747 -0.0223035 ] [ 1.4870453 3.0773927 1.7821615 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.676379908358508e-09 2.18524490230075e-09 -3.621204350446502e-09 ] [ -5.019553663724948e-10 2.366304318734765e-10 1.36171762767346e-09 ] [ 3.757531796716091e-09 -7.390813674965509e-09 -5.601164605371418e-10 ] [ 3.829410406672704e-11 3.841170383069377e-11 -3.57341462620128e-11 ] [ 2.382509213730522e-09 4.930526636960588e-09 2.855337489789859e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.916068 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.748946894066301e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7871852 2.0746679 -0.0537928 ] [ 0.2231866 2.3109659 2.335701 ] [ 2.4777675 0.3707266 0.5137538 ] [ 1.9138556 0.6071147 2.9032588 ] [ 2.7170832 2.757568 1.6071374 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.871852000000001e-11 2.0746679e-10 -5.37928e-12 ] [ 2.231866e-11 2.3109659e-10 2.335701e-10 ] [ 2.4777675e-10 3.707266e-11 5.137538e-11 ] [ 1.9138556e-10 6.071147e-11 2.9032588e-10 ] [ 2.7170832e-10 2.757568e-10 1.6071374e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.93e-05 -2.5e-06 3.9e-06 ] [ 1.21e-05 1.15e-05 -1.31e-05 ] [ 1.04e-05 6.6e-06 1.31e-05 ] [ -2.1e-06 -1.59e-05 -6e-06 ] [ -1.1e-06 4e-07 2.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.092200878144e-14 -4.005441552e-15 6.24848882112e-15 ] [ 1.938633711168e-14 1.84250311392e-14 -2.098851373248e-14 ] [ 1.666263685632e-14 1.057436569728e-14 2.098851373248e-14 ] [ -3.36457090368e-15 -2.547460827072e-14 -9.6130597248e-15 ] [ -1.76239428288e-15 6.408706483200001e-16 3.36457090368e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.901027 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.906754722290956e-18 } }