{ "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" [ [ 2.4718 1.858527 2.216013 ] [ 2.961187 3.9638 1.175243 ] [ 2.62986 4.035161 3.548452 ] [ 4.200659 2.412747 0.4103634 ] [ 4.64949 3.303863 2.581344 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4718e-10 1.858527e-10 2.216013e-10 ] [ 2.961187e-10 3.9638e-10 1.175243e-10 ] [ 2.62986e-10 4.035161000000001e-10 3.548452e-10 ] [ 4.200659e-10 2.412747e-10 4.103634e-11 ] [ 4.64949e-10 3.303863e-10 2.581344e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.8308317 -8.9834361 2.0213212 ] [ -5.3230468 8.6549158 -6.8535914 ] [ -2.739024 2.9777979 5.764621 ] [ 4.0498155 -4.0351591 -6.7119402 ] [ 10.843087 1.3858816 5.7795894 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.094419885035952e-08 -1.439305129387073e-08 3.238513569767401e-09 ] [ -8.528461134384254e-09 1.386670374975253e-08 -1.098066390959594e-08 ] [ -4.3884002166101e-09 4.770958176847336e-09 9.235940993972716e-09 ] [ 6.488519712653463e-09 -6.46503757122837e-09 -1.075371366864768e-08 ] [ 1.737254048870041e-08 2.220427098716897e-09 9.259923014503499e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 0.31738164 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.085014434791622e-20 } "relaxed-configuration-positions" { "source-value" [ [ 2.354578 1.5521137 2.3109945 ] [ 2.700285 4.4830673 0.8608242 ] [ 2.6920439 3.8390326 3.2853789 ] [ 4.0731394 2.3906042 0.6871894 ] [ 5.0929498 3.3092803 2.7870284 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.354578e-10 1.5521137e-10 2.3109945e-10 ] [ 2.700285e-10 4.4830673e-10 8.608242e-11 ] [ 2.6920439e-10 3.8390326e-10 3.2853789e-10 ] [ 4.0731394e-10 2.3906042e-10 6.871893999999999e-11 ] [ 5.092949800000001e-10 3.3092803e-10 2.7870284e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.77e-05 1.02e-05 5.4e-06 ] [ -2.46e-05 -1.2e-06 3.3e-06 ] [ 1.28e-05 -5e-07 -2.2e-06 ] [ 2.56e-05 -9.2e-06 -2.55e-05 ] [ 3.8e-06 7e-07 1.89e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.835852618816e-14 1.634220153216e-14 8.65175375232e-15 ] [ -3.941354487168e-14 -1.92261194496e-15 5.28718284864e-15 ] [ 2.050786074624e-14 -8.010883104e-16 -3.52478856576e-15 ] [ 4.101572149248001e-14 -1.474002491136e-14 -4.08555038304e-14 ] [ 6.08827115904e-15 1.12152363456e-15 3.028113813312e-14 ] ] } "relaxed-potential-energy" { "source-value" -6.9990301 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.121368239449549e-18 } }