{ "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" [ [ 0.2517942 1.00813 0.5908488 ] [ 0.7479483 2.057521 2.479291 ] [ 2.193445 0.0782553 1.774549 ] [ 2.171144 2.200702 0.4838172 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.517942e-11 1.00813e-10 5.908487999999999e-11 ] [ 7.479483e-11 2.057521e-10 2.479291e-10 ] [ 2.193445e-10 7.82553e-12 1.774549e-10 ] [ 2.171144e-10 2.200702e-10 4.838172e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.3695535 -1.8006882 -1.9934418 ] [ 0.0886988 0.9781735 2.4241224 ] [ 0.353923 -0.0913779 0.1832743 ] [ 1.9269316 0.9138927 -0.6139549 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.796443219434812e-09 -2.885020535390435e-09 -3.193845846885469e-09 ] [ 1.42111143653015e-10 1.567206712786109e-09 3.883872235237586e-09 ] [ 5.670471561633984e-10 -1.464035350378003e-10 2.936377986534854e-10 ] [ 3.087284759400737e-09 1.464217517859788e-09 -9.836641870056018e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -8.9098327 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.427512564717934e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.0460608 1.8245277 0.4885775 ] [ 0.4356374 1.252782 2.6739056 ] [ 2.6361053 0.8477779 2.1756758 ] [ 2.246528 1.4195208 -0.0096529 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.60608e-12 1.8245277e-10 4.885775e-11 ] [ 4.356374e-11 1.252782e-10 2.6739056e-10 ] [ 2.6361053e-10 8.477779e-11 2.1756758e-10 ] [ 2.246528e-10 1.4195208e-10 -9.6529e-13 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8e-06 -5.1e-06 9.3e-06 ] [ -1.39e-05 1.3e-06 1.42e-05 ] [ -7.7e-06 2.8e-06 -1e-05 ] [ 1.37e-05 1e-06 -1.36e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.28174129664e-14 -8.17110076608e-15 1.490024257344e-14 ] [ -2.227025502912e-14 2.08282960704e-15 2.275090801536e-14 ] [ -1.233675998016e-14 4.48609453824e-15 -1.6021766208e-14 ] [ 2.194981970496e-14 1.6021766208e-15 -2.178960204288e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.238204 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.800558770858104e-18 } }