{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.6618616 0.5532969 2.6678 ] [ 1.355444 2.726321 1.335983 ] [ 0.8455628 2.30582 2.977156 ] [ 2.930365 0.9373095 0.4139469 ] [ 2.829062 1.427351 2.413715 ] [ 2.781652 2.87748 1.992398 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.618616000000001e-11 5.532969e-11 2.6678e-10 ] [ 1.355444e-10 2.726321e-10 1.335983e-10 ] [ 8.455628e-11 2.30582e-10 2.977156e-10 ] [ 2.930365e-10 9.373095e-11 4.139469e-11 ] [ 2.829062e-10 1.427351e-10 2.413715e-10 ] [ 2.781652e-10 2.87748e-10 1.992398e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.3874668 -13.5697345 -2.0929383 ] [ -35.6140161 -0.483696 -34.0337487 ] [ -6.9272641 13.4295017 15.6943011 ] [ -1.9566625 1.4095441 -1.8250952 ] [ 1.4448166 -59.4076654 18.9328934 ] [ 38.6656593 58.6220502 3.3245876 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.029496789410751e-09 -2.174111154548367e-08 -3.353256840663682e-09 ] [ -5.70599444383198e-08 -7.749664291592639e-10 -5.452807693456786e-08 ] [ -1.109870067856704e-08 2.151643383000328e-08 2.51450425093805e-08 ] [ -3.134918938124025e-09 2.258338621612559e-09 -2.924124884265556e-09 ] [ 2.314851396935325e-09 -9.518157338437025e-08 3.033383941949281e-08 ] [ 6.19492158686648e-08 9.392287906761502e-08 5.326576570406137e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 11.096524 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.777859147142021e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8207856 0.2917515 3.300625 ] [ 1.4343192 3.0597103 0.8467797 ] [ 0.3400874 2.0413887 2.6810732 ] [ 2.5004544 0.838688 0.0053314 ] [ 3.0000951 1.3482082 2.5239774 ] [ 3.3082057 3.2478318 2.4432121 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.207856e-11 2.917515e-11 3.300625e-10 ] [ 1.4343192e-10 3.0597103e-10 8.467797e-11 ] [ 3.400874e-11 2.0413887e-10 2.6810732e-10 ] [ 2.5004544e-10 8.38688e-11 5.3314e-13 ] [ 3.0000951e-10 1.3482082e-10 2.5239774e-10 ] [ 3.3082057e-10 3.2478318e-10 2.443212100000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0001398 -4.8e-05 4.23e-05 ] [ -5.74e-05 4.8e-06 2.6e-05 ] [ 8.7e-05 -6.88e-05 -2.83e-05 ] [ 4.46e-05 7.47e-05 5.61e-05 ] [ 4.6e-06 0.0001676 1.3e-06 ] [ 6.1e-05 -0.0001302 -9.75e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.239842934332e-13 -7.690447843199999e-14 6.77720716182e-14 ] [ -9.196493879159998e-14 7.690447843199998e-15 4.165659248399999e-14 ] [ 1.39389367158e-13 -1.102297524192e-13 -4.53415987422e-14 ] [ 7.145707787639999e-14 1.196825945598e-13 8.988210916739999e-14 ] [ 7.370012516399999e-15 2.685248038584e-13 2.0828296242e-15 ] [ 9.773277467399998e-14 -2.086033977468e-13 -1.56212221815e-13 ] ] } "relaxed-potential-energy" { "source-value" -14.061282 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.252865746448479e-18 } }