{ "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" [ [ 2.146488 0.2959799 2.352543 ] [ 2.393537 2.53814 1.109639 ] [ 1.99319 1.640865 4.12466 ] [ 3.097066 3.51077 3.500726 ] [ 3.970578 1.750203 2.795194 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.146488e-10 2.959799e-11 2.352543e-10 ] [ 2.393537e-10 2.53814e-10 1.109639e-10 ] [ 1.99319e-10 1.640865e-10 4.12466e-10 ] [ 3.097066e-10 3.51077e-10 3.500726e-10 ] [ 3.970578e-10 1.750203e-10 2.795194e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.0156619 -5.6758751 -2.760074 ] [ -1.3968196 0.6999816 -6.8016162 ] [ -7.7851829 -0.6037194 9.2653066 ] [ 1.5933224 5.6738904 3.9144167 ] [ 9.604342 -0.0942775 -3.618033 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.229446398224044e-09 -9.093754462722412e-09 -4.422126070910915e-09 ] [ -2.237951725033226e-09 1.121494163749934e-09 -1.089739054907587e-08 ] [ -1.247323813379636e-08 -9.672651161724995e-10 1.484465774136598e-08 ] [ 2.552783919708801e-09 9.090574622756913e-09 6.271586972479386e-09 ] [ 1.538785233734483e-08 -1.51049207611935e-10 -5.796727933640922e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.910045 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.86675937088853e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.3716072 0.2906937 2.6154507 ] [ 2.3642987 2.4193667 0.5019134 ] [ 1.3987961 1.7180276 4.4357087 ] [ 3.3226212 3.3813237 4.0764393 ] [ 4.1435358 1.9265463 2.2532499 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3716072e-10 2.906937e-11 2.6154507e-10 ] [ 2.3642987e-10 2.4193667e-10 5.019133999999999e-11 ] [ 1.3987961e-10 1.7180276e-10 4.4357087e-10 ] [ 3.3226212e-10 3.3813237e-10 4.0764393e-10 ] [ 4.1435358e-10 1.9265463e-10 2.2532499e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.7e-06 1.55e-05 2.33e-05 ] [ 6.5e-06 7e-07 -9.2e-06 ] [ -1e-07 -9e-06 -3.8e-06 ] [ -6.1e-06 -5.2e-06 1.18e-05 ] [ 3.4e-06 -2e-06 -2.21e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.9280535458e-15 2.4833737827e-14 3.733071557219999e-14 ] [ 1.0414148121e-14 1.1215236438e-15 -1.47400250328e-14 ] [ -1.602176634e-16 -1.4419589706e-14 -6.088271209199999e-15 ] [ -9.773277467399999e-15 -8.331318496799998e-15 1.89056842812e-14 ] [ 5.4474005556e-15 -3.204353268e-15 -3.54081036114e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.382973 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.823753336605288e-18 } }