{ "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" [ [ 0.9096441 1.8754636 2.6586956 ] [ 0.199234 0.1752739 0.8412565 ] [ -5.020277 -3.2529697 -2.4531794 ] [ -0.9260953 -1.0882184 0.0819332 ] [ 4.8374942 2.2904505 -1.1287059 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.457410522275959e-09 3.004823957837522e-09 4.25969996723861e-09 ] [ 3.19208059498356e-10 2.808197471300526e-10 1.347841507500621e-09 ] [ -8.043370505607616e-09 -5.21183204444999e-09 -3.930426713690139e-09 ] [ -1.48376825051722e-09 -1.743518093168865e-09 1.312714585888488e-10 ] [ 7.750520174350522e-09 3.669706272433617e-09 -1.80838621963794e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.897296 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.027680609698166e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7083366 2.3251326 1.7841124 ] [ 4.7830103 1.9576614 2.7570681 ] [ 3.1054546 2.8352261 4.0494036 ] [ 3.2675949 4.4749947 2.4558787 ] [ 5.1241205 4.0171442 3.7710292 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7083366e-10 2.3251326e-10 1.7841124e-10 ] [ 4.7830103e-10 1.9576614e-10 2.7570681e-10 ] [ 3.1054546e-10 2.8352261e-10 4.0494036e-10 ] [ 3.2675949e-10 4.4749947e-10 2.4558787e-10 ] [ 5.1241205e-10 4.0171442e-10 3.7710292e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.5e-06 7.4e-06 4.01e-05 ] [ -1.06e-05 3.75e-05 -3.99e-05 ] [ -1.85e-05 6.7e-06 -3.8e-06 ] [ 1.39e-05 -4.38e-05 -2.59e-05 ] [ 7.6e-06 -7.7e-06 2.94e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.2016324755e-14 1.18561070916e-14 6.42472830234e-14 ] [ -1.69830723204e-14 6.008162377499999e-14 -6.392684769659999e-14 ] [ -2.9640267729e-14 1.07345834478e-14 -6.088271209199999e-15 ] [ 2.22702552126e-14 -7.01753365692e-14 -4.149637482059999e-14 ] [ 1.21765424184e-14 -1.23367600818e-14 4.710399303959999e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.467452 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.279247335191657e-18 } }