{ "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" [ [ 0.8403174 0.0019487 1.613535 ] [ 0.0637823 2.769237 1.974876 ] [ 2.710551 0.627508 0.2521163 ] [ 2.357874 0.9595638 1.99039 ] [ 1.619464 1.82467 0.5389468 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.403174e-11 1.9487e-13 1.613535e-10 ] [ 6.37823e-12 2.769237e-10 1.974876e-10 ] [ 2.710551e-10 6.27508e-11 2.521163e-11 ] [ 2.357874e-10 9.595638e-11 1.99039e-10 ] [ 1.619464e-10 1.82467e-10 5.389467999999999e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -20.680458 -16.8843935 -0.2016937 ] [ -4.8137623 4.5734936 0.7288673 ] [ 32.1711563 -31.4168014 -30.380967 ] [ 24.5682101 2.1905721 42.5529303 ] [ -31.245146 41.5371292 -12.6991369 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.313374658801837e-08 -2.705178074496148e-08 -3.231489333650058e-10 ] [ -7.712497478690097e-09 7.327544581668541e-09 1.167774157346668e-09 ] [ 5.154387491262189e-08 -5.033526511809848e-08 -4.867567544572507e-08 ] [ 3.93626121614228e-08 3.50968343371231e-09 6.817731063489061e-08 ] [ -5.006024284711856e-08 6.654981784767911e-08 -2.034626041314719e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 18.331267 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.936992765901528e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4004912 -0.4760382 2.1425686 ] [ 0.0598815 3.6080798 1.37059 ] [ 3.3306625 1.4133448 0.0005096 ] [ 2.824982 0.0675492 2.030142 ] [ 0.9759715 1.5699919 0.8260539 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.004912e-11 -4.760382e-11 2.1425686e-10 ] [ 5.98815e-12 3.6080798e-10 1.37059e-10 ] [ 3.3306625e-10 1.4133448e-10 5.096e-14 ] [ 2.824982e-10 6.754920000000001e-12 2.030142e-10 ] [ 9.759715e-11 1.5699919e-10 8.260539e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8e-06 -4.1e-06 -1.02e-05 ] [ 6.6e-06 -8.2e-06 1.8e-06 ] [ -1.03e-05 -4.8e-06 -6.5e-06 ] [ 1.18e-05 8.2e-06 1.45e-05 ] [ 0.0 9e-06 4e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.2817413072e-14 -6.568924199399999e-15 -1.63422016668e-14 ] [ 1.05743657844e-14 -1.31378483988e-14 2.8839179412e-15 ] [ -1.65024193302e-14 -7.690447843199998e-15 -1.0414148121e-14 ] [ 1.89056842812e-14 1.31378483988e-14 2.3231561193e-14 ] [ 0.0 1.4419589706e-14 6.408706536e-16 ] ] } "relaxed-potential-energy" { "source-value" -10.201399 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.634444311191097e-18 } }