{ "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" [ [ 2.619068 2.165174 1.589354 ] [ 4.694039 1.985014 2.658467 ] [ 3.289805 2.94692 4.226906 ] [ 3.352089 4.483007 2.429606 ] [ 5.033516 4.030044 3.913159 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.619068e-10 2.165174e-10 1.589354e-10 ] [ 4.694039000000001e-10 1.985014e-10 2.658467e-10 ] [ 3.289805e-10 2.94692e-10 4.226906e-10 ] [ 3.352089e-10 4.483007e-10 2.429606e-10 ] [ 5.033516e-10 4.030044e-10 3.913159e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1550528 0.9042491 0.4350298 ] [ 0.910348 -0.9111595 -0.542431 ] [ -3.5657148 -1.9654711 1.4206862 ] [ -1.1421645 0.2137221 -1.4372854 ] [ 3.6424785 1.7586594 0.1240004 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.484219711495782e-10 1.448766767399441e-09 6.969945749112999e-10 ] [ 1.458538282392038e-09 -1.459838448719818e-09 -8.690702665971648e-10 ] [ -5.712904889000548e-09 -3.149031845278059e-09 2.276190215133193e-09 ] [ -1.829949259007722e-09 3.424205519682797e-10 -2.302785065297177e-09 ] [ 5.835893894466653e-09 2.817682974630155e-09 1.986705418498483e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -15.215014 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.437713971594469e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8329846 2.3924036 1.7338617 ] [ 4.850434 1.7612666 2.8406383 ] [ 3.0518942 2.8153733 4.1480855 ] [ 3.1178805 4.6361285 2.4940634 ] [ 5.1353237 4.004987 3.6008431 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8329846e-10 2.3924036e-10 1.7338617e-10 ] [ 4.850434e-10 1.7612666e-10 2.840638300000001e-10 ] [ 3.0518942e-10 2.8153733e-10 4.1480855e-10 ] [ 3.1178805e-10 4.6361285e-10 2.4940634e-10 ] [ 5.1353237e-10 4.004987e-10 3.6008431e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.5e-06 -1.91e-05 -2.11e-05 ] [ 1.08e-05 -5.43e-05 -2.52e-05 ] [ -1.29e-05 -8.6e-06 5.29e-05 ] [ -9.6e-06 5.1e-05 -1.87e-05 ] [ 5.3e-06 3.11e-05 1.21e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.04141480352e-14 -3.060157345728e-14 -3.380592669888e-14 ] [ 1.730350750464e-14 -8.699819050944e-14 -4.037485084416e-14 ] [ -2.066807840832e-14 -1.377871893888e-14 8.475514324032001e-14 ] [ -1.538089555968e-14 8.17110076608e-14 -2.996070280896e-14 ] [ 8.491536090240001e-15 4.982769290688e-14 1.938633711168e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.28693 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.609453847060615e-18 } }