{ "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" [ [ 1.558502 1.467528 2.474942 ] [ 1.379624 2.873279 4.407553 ] [ 1.24144 3.597751 1.918679 ] [ 3.591005 1.301821 3.64335 ] [ 3.465479 3.687448 2.931727 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.558502e-10 1.467528e-10 2.474942e-10 ] [ 1.379624e-10 2.873279e-10 4.407553e-10 ] [ 1.24144e-10 3.597751e-10 1.918679e-10 ] [ 3.591005e-10 1.301821e-10 3.64335e-10 ] [ 3.465479e-10 3.687448e-10 2.931727e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.4531915 -2.5061893 -0.4158797 ] [ 0.1080625 0.337562 1.1202908 ] [ 0.2309022 1.4234201 -0.7549795 ] [ -0.0506783 0.8672138 -0.3098874 ] [ 0.1649051 -0.1220066 0.3604558 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.260928260452832e-10 -4.015357903759117e-09 -6.663127324053178e-10 ] [ 1.731352110852e-10 5.408339444704896e-10 1.794903728257329e-09 ] [ 3.699461065312858e-10 2.280570405796798e-09 -1.209610504083274e-09 ] [ -8.119558744188865e-11 1.389429675595127e-09 -4.964943473604979e-10 ] [ 2.642070958706861e-10 -1.954761221032973e-10 5.775138555917607e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -8.032938 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.287018545993591e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2829405 1.3947993 2.7917575 ] [ 1.3943779 2.9175226 4.5817078 ] [ 1.7289643 3.3612914 1.579724 ] [ 3.6182883 1.4778841 3.0643098 ] [ 3.211479 3.7763295 3.358752 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2829405e-10 1.3947993e-10 2.7917575e-10 ] [ 1.3943779e-10 2.9175226e-10 4.5817078e-10 ] [ 1.7289643e-10 3.3612914e-10 1.579724e-10 ] [ 3.6182883e-10 1.4778841e-10 3.0643098e-10 ] [ 3.211479e-10 3.7763295e-10 3.358752e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8.6e-06 1.24e-05 -1.29e-05 ] [ -4.2e-06 -6e-07 1.69e-05 ] [ -3.7e-06 -3.5e-06 7e-07 ] [ 7e-07 1.8e-06 7.8e-06 ] [ -1.5e-06 -1.01e-05 -1.25e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.377871893888e-14 1.986699009792e-14 -2.066807840832e-14 ] [ -6.72914180736e-15 -9.6130597248e-16 2.707678489152e-14 ] [ -5.928053496960001e-15 -5.6076181728e-15 1.12152363456e-15 ] [ 1.12152363456e-15 2.88391791744e-15 1.249697764224e-14 ] [ -2.4032649312e-15 -1.618198387008e-14 -2.002720776e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.7233245 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.397630656955185e-18 } }