{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.5419945 1.059703 1.497036 ] [ 0.5287309 2.297187 0.1799033 ] [ 1.173246 2.181689 2.79912 ] [ 2.288869 1.000101 0.1162968 ] [ 2.25753 0.9328521 1.885741 ] [ 2.965412 2.910996 0.3877363 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.419945000000001e-11 1.059703e-10 1.497036e-10 ] [ 5.287309e-11 2.297187e-10 1.799033e-11 ] [ 1.173246e-10 2.181689e-10 2.79912e-10 ] [ 2.288869e-10 1.000101e-10 1.162968e-11 ] [ 2.25753e-10 9.328521e-11 1.885741e-10 ] [ 2.965412e-10 2.910996e-10 3.877363e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -32.9610037 -23.1128054 -0.8803425 ] [ -5.8043879 18.1754624 -16.696184 ] [ -3.3760338 20.9095758 20.2698553 ] [ 4.0832581 -8.0508257 -27.012966 ] [ 34.9774365 -14.6279683 23.9805435 ] [ 3.0807307 6.7065612 0.3390937 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.28093495262423e-08 -3.703079645297999e-08 -1.410464171796624e-09 ] [ -9.299654591434409e-09 2.912030092950946e-08 -2.675023566137502e-08 ] [ -5.409002425390583e-09 3.350083349760546e-08 3.247588826865897e-08 ] [ 6.542100664512228e-09 -1.28988447146758e-08 -4.327954258366529e-08 ] [ 5.604003101581658e-08 -2.343658882006352e-08 3.842106614977741e-08 ] [ 4.935874702520819e-09 1.074509556060439e-08 5.432879984005689e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 7.9063206 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.266732202186943e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.26182 1.013388 1.4584213 ] [ 0.6621541 2.6276963 -0.337706 ] [ 0.9795663 1.9555971 3.5148705 ] [ 2.086094 0.6294922 -0.1619093 ] [ 2.7759599 1.2809179 2.1185632 ] [ 2.9901882 2.8754365 0.2735937 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6182e-11 1.013388e-10 1.4584213e-10 ] [ 6.621541e-11 2.6276963e-10 -3.37706e-11 ] [ 9.795663000000001e-11 1.9555971e-10 3.5148705e-10 ] [ 2.086094e-10 6.294922e-11 -1.619093e-11 ] [ 2.7759599e-10 1.2809179e-10 2.1185632e-10 ] [ 2.9901882e-10 2.8754365e-10 2.735937e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.9e-06 7.9e-06 -4.38e-05 ] [ 7.1e-06 -8.1e-06 3.75e-05 ] [ -6.3e-06 -1.9e-06 1.63e-05 ] [ -1.06e-05 -3.37e-05 1.79e-05 ] [ 8.5e-06 4e-06 -8.2e-06 ] [ 1.02e-05 3.18e-05 -1.97e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.425937192512e-14 1.265719530432e-14 -7.017533599104001e-14 ] [ 1.137545400768e-14 -1.297763062848e-14 6.008162327999999e-14 ] [ -1.009371271104e-14 -3.04413557952e-15 2.611547891904e-14 ] [ -1.698307218048e-14 -5.399335212096e-14 2.867896151232001e-14 ] [ 1.36185012768e-14 6.4087064832e-15 -1.313784829056e-14 ] [ 1.634220153216e-14 5.094921654144e-14 -3.156287942976e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.893401 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.866838874879934e-18 } }