{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.290406 1.365127 2.478138 ] [ 1.892594 2.812526 4.141756 ] [ 2.634032 3.625436 1.937955 ] [ 4.696761 2.293416 2.137678 ] [ 4.185297 2.165547 4.431715 ] [ 4.453239 5.273552 2.545611 ] [ 3.870361 4.380343 4.592008 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.290406e-10 1.365127e-10 2.478138e-10 ] [ 1.892594e-10 2.812526e-10 4.141756e-10 ] [ 2.634032e-10 3.625436e-10 1.937955e-10 ] [ 4.696761000000001e-10 2.293416e-10 2.137678e-10 ] [ 4.185297000000001e-10 2.165547e-10 4.431715e-10 ] [ 4.453239e-10 5.273551999999999e-10 2.545611e-10 ] [ 3.870361e-10 4.380343e-10 4.592008e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1472405 -1.613462 -1.3050888 ] [ 0.2056857 1.392462 0.7501779 ] [ 0.7483043 1.1314147 -0.205417 ] [ -0.7587851 1.1454945 0.402942 ] [ 0.6953396 -0.6709601 0.281031 ] [ -0.7967704 -1.9408634 -0.4500132 ] [ -0.2410146 0.5559142 0.526368 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.35905288678477e-10 -2.585051116246907e-09 -2.090982780655099e-09 ] [ 3.295448224879338e-10 2.230970080132908e-09 1.201917502723188e-09 ] [ 1.198915664581726e-09 1.81272619570412e-09 -3.291143176263779e-10 ] [ -1.215707757447353e-09 1.835284522275513e-09 6.45584257257228e-10 ] [ 1.114056859814906e-09 -1.074996594566303e-09 4.502613016296539e-10 ] [ -1.276566917542833e-09 -3.109605989265795e-09 -7.210006340315687e-10 ] [ -3.861479605728564e-10 8.906727417488028e-10 8.433345104853118e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -18.700416005765543 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.996136957051716e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5822545 1.6233096 2.0994672 ] [ 2.0891719 2.8486538 4.1197895 ] [ 2.1114347 3.9804181 1.99588 ] [ 4.7733302 2.3032197 2.4456978 ] [ 4.3073524 2.1015745 4.7095835 ] [ 4.3380187 4.6043643 2.3117589 ] [ 3.8211275 4.454407 4.5826841 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5822545e-10 1.6233096e-10 2.0994672e-10 ] [ 2.0891719e-10 2.8486538e-10 4.1197895e-10 ] [ 2.1114347e-10 3.9804181e-10 1.99588e-10 ] [ 4.773330200000001e-10 2.3032197e-10 2.4456978e-10 ] [ 4.3073524e-10 2.1015745e-10 4.7095835e-10 ] [ 4.3380187e-10 4.6043643e-10 2.3117589e-10 ] [ 3.8211275e-10 4.454407e-10 4.5826841e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.25e-05 6.6e-06 -5.7e-06 ] [ 1.81e-05 -4.8e-06 1.2e-06 ] [ 4e-07 -1.78e-05 -4.7e-06 ] [ -1.39e-05 2.6e-06 1.63e-05 ] [ 1.5e-06 -1.35e-05 -4.4e-06 ] [ 1.33e-05 1.51e-05 -1.03e-05 ] [ -7e-06 1.18e-05 7.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.0027207925e-14 1.05743657844e-14 -9.1324068138e-15 ] [ 2.899939707539999e-14 -7.690447843199998e-15 1.9226119608e-15 ] [ 6.408706536e-16 -2.851874408519999e-14 -7.530230179799999e-15 ] [ -2.22702552126e-14 4.165659248399999e-15 2.61154791342e-14 ] [ 2.403264951e-15 -2.162938455899999e-14 -7.0495771896e-15 ] [ 2.13089492322e-14 2.41928671734e-14 -1.65024193302e-14 ] [ -1.1215236438e-14 1.89056842812e-14 1.21765424184e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.807805005765545 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.333777898506579e-18 } }