{ "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" [ [ 2.619068 2.165174 1.589354 ] [ 4.694039 1.985014 2.658467 ] [ 3.289805 2.94692 4.226906 ] [ 3.352089 4.483007 2.429606 ] [ 5.033516 4.030044 3.913159 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.619068e-10 2.165174e-10 1.589354e-10 ] [ 4.694039000000001e-10 1.985014e-10 2.658467e-10 ] [ 3.289805e-10 2.94692e-10 4.226906e-10 ] [ 3.352089e-10 4.483007e-10 2.429606e-10 ] [ 5.033516e-10 4.030044e-10 3.913159e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.6447489 0.9823135 0.8083914 ] [ 0.3627542 -0.8578007 -0.3935805 ] [ -2.9549567 -1.7267605 0.672391 ] [ -1.0548065 0.0903102 -0.9961776 ] [ 3.0022601 1.5119375 -0.0910243 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.033001613866517e-09 1.573839723996221e-09 1.295185801535781e-09 ] [ 5.811962983370074e-10 -1.374348226845874e-09 -6.305854755027744e-10 ] [ -4.734362540216319e-09 -2.766575302820919e-09 1.077289140236333e-09 ] [ -1.689986313767875e-09 1.446928910597722e-10 -1.596052460884654e-09 ] [ 4.81015094178067e-09 2.4223909146108e-09 -1.458370053846855e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -13.541494 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.169586509750348e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8419729 2.4011395 1.746468 ] [ 4.8386169 1.7746832 2.8392989 ] [ 3.0551861 2.8182578 4.1459559 ] [ 3.1280523 4.6212692 2.4964618 ] [ 5.1246888 3.9948093 3.5893074 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8419729e-10 2.4011395e-10 1.746468e-10 ] [ 4.8386169e-10 1.7746832e-10 2.8392989e-10 ] [ 3.0551861e-10 2.8182578e-10 4.1459559e-10 ] [ 3.1280523e-10 4.621269200000001e-10 2.4964618e-10 ] [ 5.124688800000001e-10 3.9948093e-10 3.5893074e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1e-05 -4.5e-06 -1.09e-05 ] [ -1.8e-06 8e-07 -6.9e-06 ] [ -2.24e-05 -1.63e-05 3.73e-05 ] [ 8.8e-06 1.2e-05 -5.5e-06 ] [ 5.4e-06 8.1e-06 -1.39e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.6021766208e-14 -7.2097947936e-15 -1.746372516672e-14 ] [ -2.88391791744e-15 1.28174129664e-15 -1.105501868352e-14 ] [ -3.588875630592e-14 -2.611547891904e-14 5.976118795584e-14 ] [ 1.409915426304e-14 1.92261194496e-14 -8.8119714144e-15 ] [ 8.65175375232e-15 1.297763062848e-14 -2.227025502912e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.50509 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.323971608059987e-18 } }