{ "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" [ [ 0.4009464 1.193297 0.9558509 ] [ 0.2244953 2.906435 0.4394059 ] [ 0.3187826 2.815079 2.795658 ] [ 1.502588 0.0124763 2.860219 ] [ 2.103704 2.743898 0.1444875 ] [ 2.704733 1.991532 2.940817 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.009464e-11 1.193297e-10 9.558509e-11 ] [ 2.244953e-11 2.906435e-10 4.394059e-11 ] [ 3.187826e-11 2.815079e-10 2.795658e-10 ] [ 1.502588e-10 1.24763e-12 2.860219e-10 ] [ 2.103704e-10 2.743898e-10 1.444875e-11 ] [ 2.704733e-10 1.991532e-10 2.940817e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.9453872 -13.7155906 1.3978549 ] [ -5.5198445 7.4501095 -4.3483947 ] [ 0.700002 2.2156975 6.6478894 ] [ -0.4008295 0.5094067 -0.8518694 ] [ 7.4770126 4.8660531 -9.8983049 ] [ 0.6890466 -1.3256762 7.0528247 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.719030549922684e-09 -2.197479878083004e-08 2.239610458502406e-09 ] [ -8.843765881213411e-09 1.193639136164142e-08 -6.966896383749439e-09 ] [ 1.121526848153268e-09 3.549938762512215e-09 1.065109306209628e-08 ] [ -6.42199659117903e-10 8.161595119430478e-10 -1.364845247899599e-09 ] [ 1.197949487984359e-08 7.796276576623265e-09 -1.58588328269877e-08 ] [ 1.103974362257144e-09 -2.123967431889911e-09 1.129987093803806e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -11.504937 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.843294123704206e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.6109244 0.9902702 1.1080392 ] [ 0.8460789 3.6880307 0.6010546 ] [ 0.2152175 2.8239051 2.7746979 ] [ 2.4401116 0.360623 2.4502411 ] [ 1.32271 1.9657845 -0.9496463 ] [ 1.8202069 1.8341037 4.1520518 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.109244e-11 9.902702e-11 1.1080392e-10 ] [ 8.460789e-11 3.6880307e-10 6.010546e-11 ] [ 2.152175e-11 2.8239051e-10 2.7746979e-10 ] [ 2.4401116e-10 3.606230000000001e-11 2.4502411e-10 ] [ 1.32271e-10 1.9657845e-10 -9.496463000000001e-11 ] [ 1.8202069e-10 1.8341037e-10 4.1520518e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.8e-06 8.4e-06 2.65e-05 ] [ -5e-06 -9.1e-06 8e-07 ] [ -5.9e-06 5e-07 -2.17e-05 ] [ -4.7e-06 2e-07 -1.49e-05 ] [ 9.5e-06 5.2e-06 -2.4e-06 ] [ 8.9e-06 -5.2e-06 1.17e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.486094575199999e-15 1.34582837256e-14 4.2457680801e-14 ] [ -8.010883169999999e-15 -1.45798073694e-14 1.2817413072e-15 ] [ -9.452842140600001e-15 8.010883169999999e-16 -3.476723295779999e-14 ] [ -7.530230179799999e-15 3.204353268e-16 -2.38724318466e-14 ] [ 1.5220678023e-14 8.331318496799998e-15 -3.845223921599999e-15 ] [ 1.42593720426e-14 -8.331318496799998e-15 1.87454666178e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.757214 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.005236998973768e-18 } }