{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.462385 1.450975 0.2684659 ] [ 3.060126 2.637643 2.086081 ] [ 2.184778 3.8492 0.5676389 ] [ 4.510071 4.418515 1.324556 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.462385e-10 1.450975e-10 2.684659e-11 ] [ 3.060126e-10 2.637643e-10 2.086081e-10 ] [ 2.184778e-10 3.849200000000001e-10 5.676389e-11 ] [ 4.510071e-10 4.418515e-10 1.324556e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.6027845 -0.4562835 -1.1013481 ] [ 2.6184976 -1.6471201 4.3130534 ] [ -0.9280932 2.4378018 -3.1529836 ] [ -1.08762 -0.3343983 -0.0587217 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.657672412373728e-10 -7.310467621797389e-10 -1.764554191720295e-09 ] [ 4.195295670905078e-09 -2.638977337611743e-09 6.910273378674255e-09 ] [ -1.486969239214289e-09 3.905789082283141e-09 -5.051636651305203e-09 ] [ -1.74255935067108e-09 -5.357651427093221e-10 -9.408253564875779e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -9.6845242 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.551631838464754e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2218055 1.4818478 0.3269709 ] [ 3.3266704 2.4984368 2.1550596 ] [ 2.3584205 3.8434427 0.3099346 ] [ 4.3104637 4.5326057 1.4547768 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2218055e-10 1.4818478e-10 3.269709e-11 ] [ 3.3266704e-10 2.4984368e-10 2.1550596e-10 ] [ 2.3584205e-10 3.8434427e-10 3.099346e-11 ] [ 4.3104637e-10 4.532605700000001e-10 1.4547768e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3e-07 -1.06e-05 -1.5e-06 ] [ -1.9e-06 2.9e-06 -1e-06 ] [ -1.13e-05 4.3e-06 -3.7e-06 ] [ 1.29e-05 3.4e-06 6.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.806529901999999e-16 -1.69830723204e-14 -2.403264951e-15 ] [ -3.0441356046e-15 4.6463122386e-15 -1.602176634e-15 ] [ -1.81045959642e-14 6.8893595262e-15 -5.9280535458e-15 ] [ 2.06680785786e-14 5.4474005556e-15 9.773277467399999e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.547084 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.689829154163525e-18 } }