{ "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" [ [ 1.26541 0.4689135 1.770405 ] [ 0.1075881 2.160004 0.6716672 ] [ 0.5668509 2.899878 2.242644 ] [ 2.824031 1.222886 2.646945 ] [ 2.932592 2.399832 0.52394 ] [ 1.820297 2.092873 2.325497 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.26541e-10 4.689135e-11 1.770405e-10 ] [ 1.075881e-11 2.160004e-10 6.716672e-11 ] [ 5.668509000000001e-11 2.899878e-10 2.242644e-10 ] [ 2.824031e-10 1.222886e-10 2.646945e-10 ] [ 2.932592e-10 2.399832e-10 5.2394e-11 ] [ 1.820297e-10 2.092873e-10 2.325497e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -19.6642822 -31.1333481 -13.4796789 ] [ -6.8719699 -6.4833873 -17.3844896 ] [ -74.6210183 57.02038 13.3364746 ] [ 73.7180345 -50.0088751 29.3532019 ] [ 4.9035735 1.7194548 -6.0010574 ] [ 22.5356624 28.8857757 -5.8244507 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.150565320565359e-08 -4.98811224530481e-08 -2.159682638947106e-08 ] [ -1.101010951262131e-08 -1.038753155565164e-08 -2.785302280166074e-08 ] [ -1.19556050940549e-07 9.135671974513192e-08 2.136738780801303e-08 ] [ 1.181093114072278e-07 -8.012305051772725e-08 4.702901382980214e-08 ] [ 7.85639082007443e-09 2.75487028108234e-09 -9.614753866358834e-09 ] [ 3.610611143152161e-08 4.628011450021276e-08 -9.331798740542194e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 31.478227 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.043367936363533e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.658718 0.3247128 1.9681175 ] [ 0.5848911 1.9183162 0.1705033 ] [ 0.0790608 2.6140385 2.4147283 ] [ 2.9491917 0.8348015 2.326262 ] [ 2.87537 2.4283939 0.5286309 ] [ 2.3695374 3.1241236 2.7728562 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.58718e-11 3.247128e-11 1.9681175e-10 ] [ 5.848911e-11 1.9183162e-10 1.705033e-11 ] [ 7.90608e-12 2.6140385e-10 2.4147283e-10 ] [ 2.9491917e-10 8.348015e-11 2.326262e-10 ] [ 2.87537e-10 2.4283939e-10 5.286309000000001e-11 ] [ 2.3695374e-10 3.1241236e-10 2.7728562e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.9e-06 3.19e-05 1.98e-05 ] [ 3.17e-05 -3.1e-06 1.33e-05 ] [ 1.55e-05 -1.75e-05 -3.2e-06 ] [ -2.49e-05 1.08e-05 -3.01e-05 ] [ -1.04e-05 -2.2e-06 1.5e-05 ] [ -1.97e-05 -2e-05 -1.48e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.265719530432e-14 5.110943420352001e-14 3.172309709184e-14 ] [ 5.078899887936e-14 -4.96674752448e-15 2.130894905664e-14 ] [ 2.48337376224e-14 -2.8038090864e-14 -5.126965186560001e-15 ] [ -3.989419785791999e-14 1.730350750464e-14 -4.822551628608e-14 ] [ -1.666263685632e-14 -3.52478856576e-15 2.4032649312e-14 ] [ -3.156287942976e-14 -3.2043532416e-14 -2.371221398784e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.513765 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.806014482518531e-18 } }