{ "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" [ [ 1.60665 2.271209 0.858315 ] [ 1.14021 1.706761 3.269891 ] [ 0.6855745 3.746661 2.498398 ] [ 2.590166 5.193842 1.980174 ] [ 3.090456 3.322533 2.927067 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.60665e-10 2.271209e-10 8.58315e-11 ] [ 1.14021e-10 1.706761e-10 3.269891e-10 ] [ 6.855745e-11 3.746661e-10 2.498398e-10 ] [ 2.590166e-10 5.193842e-10 1.980174e-10 ] [ 3.090456e-10 3.322533e-10 2.927067e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.6835958 -2.3411196 -4.02444 ] [ -0.7428676 -2.2012603 1.9880944 ] [ -3.5812901 2.0771918 0.0073036 ] [ 0.4495474 3.058355 -0.3845396 ] [ 4.5582061 -0.5931669 2.4135816 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.095241208837073e-09 -3.750887089616648e-09 -6.447863679812353e-09 ] [ -1.190205101069806e-09 -3.526807788955194e-09 3.185278367623403e-09 ] [ -5.737859270522494e-09 3.32802813887747e-09 1.170165716767488e-11 ] [ 7.202543342214259e-10 4.900024879106784e-09 -6.161003568917837e-10 ] [ 7.303051246207947e-09 -9.503581394124116e-10 3.866984011913058e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.2191578 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.477071909062596e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.566291 2.0394054 1.3182209 ] [ 2.1518389 1.3764774 2.9453662 ] [ 0.4768348 4.4035762 1.3689086 ] [ 2.4153214 5.1577355 2.496051 ] [ 3.5027704 3.2638115 3.4052983 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.66291e-11 2.0394054e-10 1.3182209e-10 ] [ 2.1518389e-10 1.3764774e-10 2.9453662e-10 ] [ 4.768348e-11 4.4035762e-10 1.3689086e-10 ] [ 2.4153214e-10 5.157735500000001e-10 2.496051e-10 ] [ 3.502770400000001e-10 3.2638115e-10 3.4052983e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.25e-05 -7e-06 -4.5e-06 ] [ -9.6e-06 1.12e-05 2.2e-06 ] [ 6.4e-06 6.5e-06 1.53e-05 ] [ -9.1e-06 -6.5e-06 -8.8e-06 ] [ -2e-07 -4.2e-06 -4.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.002720776e-14 -1.12152363456e-14 -7.2097947936e-15 ] [ -1.538089555968e-14 1.794437815296e-14 3.52478856576e-15 ] [ 1.025393037312e-14 1.04141480352e-14 2.451330229824e-14 ] [ -1.457980724928e-14 -1.04141480352e-14 -1.409915426304e-14 ] [ -3.2043532416e-16 -6.72914180736e-15 -6.72914180736e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.976835 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.239335826977917e-18 } }