{ "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" [ [ 1.63984 2.632724 3.733643 ] [ 2.059322 3.100925 1.548727 ] [ 0.4497259 4.960249 3.35449 ] [ 2.730005 4.489518 3.533282 ] [ 4.056337 2.434117 2.913545 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.63984e-10 2.632724e-10 3.733643e-10 ] [ 2.059322e-10 3.100925e-10 1.548727e-10 ] [ 4.497259e-11 4.960249e-10 3.35449e-10 ] [ 2.730005e-10 4.489518e-10 3.533282e-10 ] [ 4.056337e-10 2.434117e-10 2.913545e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.9668974 4.0647075 -4.0910666 ] [ 3.3176486 -3.1840113 2.8455421 ] [ -0.8831509 0.1039449 3.4014293 ] [ -0.9125193 -1.3212204 -1.3482994 ] [ -0.5550811 0.3365794 -0.8076054 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.549140421755352e-09 6.512379380544554e-09 -6.554611314657825e-09 ] [ 5.315459066742812e-09 -5.101348507251963e-09 4.55906106368329e-09 ] [ -1.41496373627607e-09 1.665380900034666e-10 5.449690546662976e-09 ] [ -1.462017100534036e-09 -2.116828453244133e-09 -2.160213794316219e-09 ] [ -8.893379683950173e-10 5.392596501657394e-10 -1.293926501372223e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 4.724825374023453 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.570004813990687e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.6162056 2.7320797 3.633643 ] [ 2.140417 3.0230966 1.618282 ] [ 0.4281386 4.9627898 3.4376328 ] [ 2.7076998 4.4572227 3.5003248 ] [ 4.0427689 2.4423442 2.8938043 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6162056e-10 2.7320797e-10 3.633643000000001e-10 ] [ 2.140417e-10 3.023096600000001e-10 1.618282e-10 ] [ 4.281386e-11 4.962789800000001e-10 3.4376328e-10 ] [ 2.7076998e-10 4.4572227e-10 3.5003248e-10 ] [ 4.042768900000001e-10 2.4423442e-10 2.8938043e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.7479789 -11.7384525 17.3634477 ] [ 2.6923421 -15.5140067 -41.8073671 ] [ -2.3923173 1.561792 5.5115486 ] [ 9.0644283 30.9936268 17.9211209 ] [ 0.3835258 -5.3029596 1.0112499 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.561798402230502e-08 -1.880707431481888e-08 2.781931019062103e-08 ] [ 4.313607603354491e-09 -2.485617903445944e-08 -6.698278669668034e-08 ] [ -3.832914879173968e-09 2.502266649568128e-09 8.830474384075413e-09 ] [ 1.452281522282834e-08 4.965726466187619e-08 2.871280116106905e-08 ] [ 6.144760752961572e-10 -8.496277962165986e-09 1.620200960914836e-09 ] ] } "relaxed-potential-energy" { "source-value" 3.7511603740234527 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.010021501647076e-19 } }