{ "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" [ [ 0.6660422 0.1321237 2.521111 ] [ 1.154832 2.450071 0.6217319 ] [ 0.2052378 1.707228 1.69737 ] [ 2.767871 1.123615 2.427941 ] [ 1.781428 1.004966 1.555643 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.660422e-11 1.321237e-11 2.521111e-10 ] [ 1.154832e-10 2.450071e-10 6.217319e-11 ] [ 2.052378e-11 1.707228e-10 1.69737e-10 ] [ 2.767871e-10 1.123615e-10 2.427941e-10 ] [ 1.781428e-10 1.004966e-10 1.555643e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.4018978 -252.6588652 167.3368631 ] [ 381.0869342 453.4208694 -527.8957382 ] [ -597.943583 -24.6596793 435.816571 ] [ 2448.945018 387.0719165 2272.4534594 ] [ -2235.4902671 -563.1742415 -2347.7111553 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.450441166416005e-09 -4.048041301963957e-07 2.681032120656768e-07 ] [ 6.105685814979354e-07 7.264603223206456e-07 -8.457822169322212e-07 ] [ -9.580112371328395e-07 -3.950916197639347e-08 6.98255126766202e-07 ] [ 3.923642485790309e-06 6.20157580293899e-07 3.640871834503148e-06 ] [ -3.581650271482038e-06 -9.023046106019731e-07 -3.761447956402805e-06 ] ] } "unrelaxed-potential-energy" { "source-value" 952.15476 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.525520108423878e-16 } "relaxed-configuration-positions" { "source-value" [ [ 0.0671281 -0.4821411 2.6068473 ] [ 1.1292637 2.8313426 0.0458875 ] [ -0.4215806 1.9940703 1.9636913 ] [ 3.8496834 1.3170822 2.859444 ] [ 1.9509164 0.7576497 1.3479268 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.71281e-12 -4.821411e-11 2.6068473e-10 ] [ 1.1292637e-10 2.8313426e-10 4.58875e-12 ] [ -4.215806e-11 1.9940703e-10 1.9636913e-10 ] [ 3.8496834e-10 1.3170822e-10 2.859444e-10 ] [ 1.9509164e-10 7.576497e-11 1.3479268e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.1e-06 -7.2e-06 -1e-06 ] [ 2.2e-06 2.07e-05 1.01e-05 ] [ -1.46e-05 1.92e-05 -2.9e-06 ] [ -3.41e-05 1.39e-05 -3.9e-05 ] [ 5.46e-05 -4.66e-05 3.28e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.29776307354e-14 -1.15356717648e-14 -1.602176634e-15 ] [ 3.5247885948e-15 3.316505632379999e-14 1.61819840034e-14 ] [ -2.33917788564e-14 3.076179137279999e-14 -4.6463122386e-15 ] [ -5.46342232194e-14 2.22702552126e-14 -6.248488872599999e-14 ] [ 8.74788442164e-14 -7.466143114439999e-14 5.255139359519999e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.741214 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.522020526159367e-18 } }