{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.799229 1.39947 2.90942 ] [ 1.755424 3.290747 3.119725 ] [ 4.105166 3.028799 1.978791 ] [ 3.422089 4.791435 3.468124 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.799229e-10 1.39947e-10 2.90942e-10 ] [ 1.755424e-10 3.290747e-10 3.119725e-10 ] [ 4.105166e-10 3.028799e-10 1.978791e-10 ] [ 3.422089e-10 4.791435e-10 3.468124e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5174001 -1.7460195 0.0049025 ] [ -2.646966 1.0197458 0.6705888 ] [ 1.4418322 0.4214616 -0.5761296 ] [ 0.6877337 0.3048121 -0.0993618 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.289663506492633e-10 -2.797431645408363e-09 7.854670948184998e-12 ] [ -4.240907076192443e-09 1.633812893379637e-09 1.074401706382099e-09 ] [ 2.310069860988814e-09 6.752559276482543e-10 -9.230613832757664e-10 ] [ 1.101870864554366e-09 4.883628243804713e-10 -1.591951542721812e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -7.984497246151737 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.279257492202166e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.73484 1.5663144 2.6249423 ] [ 1.5704393 3.2879707 3.540215 ] [ 4.470391 2.9673219 2.1975353 ] [ 3.3062378 4.6888441 3.1133673 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.73484e-10 1.5663144e-10 2.6249423e-10 ] [ 1.5704393e-10 3.2879707e-10 3.540215e-10 ] [ 4.470391000000001e-10 2.9673219e-10 2.1975353e-10 ] [ 3.3062378e-10 4.6888441e-10 3.1133673e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.6e-05 7.5e-06 1.7e-06 ] [ 4.86e-05 -2.4e-05 -1.55e-05 ] [ -1.77e-05 5.2e-06 2.04e-05 ] [ -5e-06 1.13e-05 -6.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.165659248399999e-14 1.2016324755e-14 2.7237002778e-15 ] [ 7.786578441239999e-14 -3.8452239216e-14 -2.4833737827e-14 ] [ -2.83585264218e-14 8.331318496799998e-15 3.26844033336e-14 ] [ -8.010883169999999e-15 1.81045959642e-14 -1.05743657844e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.97474264615174 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.437912296382764e-18 } }