{ "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" [ [ 2.246807 1.041122 2.124463 ] [ 1.267764 1.326115 3.99765 ] [ 2.011294 2.700157 5.439591 ] [ 2.31677 3.176049 2.822929 ] [ 4.533635 0.1687206 2.857812 ] [ 4.258439 2.493804 2.204153 ] [ 4.092776 1.731475 4.602458 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.246807e-10 1.041122e-10 2.124463e-10 ] [ 1.267764e-10 1.326115e-10 3.99765e-10 ] [ 2.011294e-10 2.700157e-10 5.439591000000001e-10 ] [ 2.31677e-10 3.176049e-10 2.822929e-10 ] [ 4.533635000000001e-10 1.687206e-11 2.857812e-10 ] [ 4.258439e-10 2.493804e-10 2.204153e-10 ] [ 4.092776e-10 1.731475e-10 4.602458e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.2097573 -6.3287831 -8.0590265 ] [ -6.2560309 -4.2665466 2.5929154 ] [ 1.7533383 3.2409403 4.0820533 ] [ -4.108672 7.7088351 0.9395558 ] [ 0.3299718 -2.3667468 -1.0036255 ] [ 6.2367019 0.8303215 -2.6189356 ] [ 1.8349335 1.1819796 4.0670632 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.360682421021319e-10 -1.013982832093415e-08 -1.291198384470765e-08 ] [ -1.002326644698238e-08 -6.835761214073729e-09 4.154308433592281e-09 ] [ 2.809157632613217e-09 5.192558778068538e-09 6.540170362119489e-09 ] [ -6.582818220935578e-09 1.235091537082243e-08 1.505334336697041e-09 ] [ 5.286731034832935e-10 -3.791946390313214e-09 -1.607985312138711e-09 ] [ 9.99229797507894e-09 1.330321695047587e-09 -4.19599738970082e-09 ] [ 2.939887554422717e-09 1.893740081382536e-09 6.516153574356034e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.940036 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.913004653071035e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3784103 0.9033638 1.9560003 ] [ 0.951088 1.2333875 3.998462 ] [ 2.2341255 2.8836045 5.3823161 ] [ 1.975803 3.366096 2.8649404 ] [ 4.5612523 -0.0072961 2.8253543 ] [ 4.3565745 2.5931088 2.3224783 ] [ 4.2702314 1.665178 4.6995045 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3784103e-10 9.033638000000001e-11 1.9560003e-10 ] [ 9.510880000000001e-11 1.2333875e-10 3.998462e-10 ] [ 2.2341255e-10 2.8836045e-10 5.382316099999999e-10 ] [ 1.975803e-10 3.366096e-10 2.8649404e-10 ] [ 4.5612523e-10 -7.2961e-13 2.8253543e-10 ] [ 4.3565745e-10 2.5931088e-10 2.3224783e-10 ] [ 4.2702314e-10 1.665178e-10 4.6995045e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.1e-05 -5.16e-05 -6.99e-05 ] [ -3.97e-05 4.35e-05 5.73e-05 ] [ 8e-07 -6.4e-06 -2.38e-05 ] [ -4.6e-06 -6.7e-06 1.36e-05 ] [ 1.5e-06 -7e-06 -2.18e-05 ] [ -2.1e-06 2.66e-05 1.08e-05 ] [ 1.32e-05 1.7e-06 3.38e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.96674752448e-14 -8.267231363328e-14 -1.1199214579392e-13 ] [ -6.360641184576e-14 6.969468300480001e-14 9.180472037184001e-14 ] [ 1.28174129664e-15 -1.025393037312e-14 -3.813180357504e-14 ] [ -7.370012455680001e-15 -1.073458335936e-14 2.178960204288e-14 ] [ 2.4032649312e-15 -1.12152363456e-14 -3.492745033344e-14 ] [ -3.36457090368e-15 4.261789811328e-14 1.730350750464e-14 ] [ 2.114873139456e-14 2.72370025536e-15 5.415356978304e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.087087 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.737653130897561e-18 } }