{ "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" [ [ 2.194843 2.698336 1.615904 ] [ 2.342296 1.479956 3.870973 ] [ 2.299802 3.774539 3.510423 ] [ 4.310954 2.51113 2.445623 ] [ 3.93016 4.43603 0.8578151 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.194843e-10 2.698336e-10 1.615904e-10 ] [ 2.342296e-10 1.479956e-10 3.870973000000001e-10 ] [ 2.299802e-10 3.774539e-10 3.510423e-10 ] [ 4.310954e-10 2.51113e-10 2.445623e-10 ] [ 3.93016e-10 4.43603e-10 8.578151e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4503525 -0.893369 -1.2905881 ] [ 0.9863443 0.8748358 -1.7944316 ] [ 1.4098515 0.6867986 1.0277109 ] [ -2.1191791 1.0685356 0.7221654 ] [ -0.7273692 -1.7368011 1.3351434 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.215442525634849e-10 -1.431334937339946e-09 -2.067750097938455e-09 ] [ 1.580297790539086e-09 1.401641477346697e-09 -2.874996380831234e-09 ] [ 2.258831130709851e-09 1.100372669183912e-09 1.64657439048711e-09 ] [ -3.39529923728115e-09 1.71198277091717e-09 1.157036529763263e-09 ] [ -1.165373936531273e-09 -2.782662140325497e-09 2.139135558519315e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.818273 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.854802065883308e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.173866 2.5146747 1.4897914 ] [ 2.3833557 1.6236417 3.6590277 ] [ 2.5900933 3.9455283 3.3280966 ] [ 4.2828744 2.4797924 2.5625564 ] [ 3.6478656 4.336354 1.2612659 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.173866e-10 2.5146747e-10 1.4897914e-10 ] [ 2.3833557e-10 1.6236417e-10 3.6590277e-10 ] [ 2.5900933e-10 3.9455283e-10 3.3280966e-10 ] [ 4.2828744e-10 2.4797924e-10 2.5625564e-10 ] [ 3.6478656e-10 4.336354e-10 1.2612659e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5e-07 -1.6e-06 -7.8e-06 ] [ -1.1e-06 -8e-06 7.7e-06 ] [ -1.61e-05 2.35e-05 9e-06 ] [ 1.7e-05 -1.72e-05 -9.1e-06 ] [ -4e-07 3.3e-06 2e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.010883169999999e-16 -2.5634826144e-15 -1.24969777452e-14 ] [ -1.7623942974e-15 -1.2817413072e-14 1.23367600818e-14 ] [ -2.579504380739999e-14 3.765115089899999e-14 1.4419589706e-14 ] [ 2.723700277799999e-14 -2.75574381048e-14 -1.45798073694e-14 ] [ -6.408706536e-16 5.2871828922e-15 3.204353268e-16 ] ] } "relaxed-potential-energy" { "source-value" -20.398784 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.268245508681305e-18 } }