{ "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" [ [ 1.135722 0.0671856 0.8418581 ] [ 1.330168 2.113646 0.0657344 ] [ 0.0470942 1.897018 2.992181 ] [ 2.611886 0.9021473 0.0602941 ] [ 2.88133 0.1204436 1.620481 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.135722e-10 6.71856e-12 8.418581000000001e-11 ] [ 1.330168e-10 2.113646e-10 6.57344e-12 ] [ 4.70942e-12 1.897018e-10 2.992181e-10 ] [ 2.611886e-10 9.021473000000001e-11 6.02941e-12 ] [ 2.88133e-10 1.204436e-11 1.620481e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -19.7034577 -6.3406036 4.0820662 ] [ -13.034808 13.6215773 1.9855355 ] [ 1.8468703 -1.548534 -3.9767726 ] [ 20.1276295 0.9075924 -21.0520168 ] [ 10.7637659 -6.6400322 18.9611877 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.156841927586174e-08 -1.015876684968032e-08 6.540191030197897e-09 ] [ -2.088406463421681e-08 2.182417268847999e-08 3.181178557868438e-09 ] [ 2.959012416309882e-09 -2.481024971313908e-09 -6.371492085958029e-09 ] [ 3.22480174170244e-08 1.454123324495762e-09 -3.372904913764883e-08 ] [ 1.724545407674427e-08 -1.063850435219919e-08 3.037917163554053e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -0.075001294 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.201653197765473e-20 } "relaxed-configuration-positions" { "source-value" [ [ 0.7384836 -0.041576 0.7530103 ] [ 1.3831009 2.3185029 0.5966317 ] [ 0.4451785 1.4370765 2.6437999 ] [ 2.7573063 0.6031033 -0.4115796 ] [ 2.682131 0.7833338 1.9986863 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.384836e-11 -4.1576e-12 7.530103e-11 ] [ 1.3831009e-10 2.3185029e-10 5.966317e-11 ] [ 4.451785e-11 1.4370765e-10 2.6437999e-10 ] [ 2.757306300000001e-10 6.031033e-11 -4.115796e-11 ] [ 2.682131e-10 7.833338e-11 1.9986863e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.7e-05 -3.67e-05 -1.87e-05 ] [ 2.79e-05 2.73e-05 -2.37e-05 ] [ -4.88e-05 -2.5e-06 3.95e-05 ] [ -7e-07 -1e-06 -1.98e-05 ] [ 5.87e-05 1.3e-05 2.28e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.92805349696e-14 -5.879988198335999e-14 -2.996070280896e-14 ] [ 4.470072772032e-14 4.373942174784e-14 -3.797158591296e-14 ] [ -7.818621909504e-14 -4.005441552e-15 6.32859765216e-14 ] [ -1.12152363456e-15 -1.6021766208e-15 -3.172309709184e-14 ] [ 9.404776764096e-14 2.08282960704e-14 3.652962695424e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.096417 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.899365623764767e-18 } }