{ "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" [ [ 0.5308739 0.2525778 2.81745 ] [ 0.4737551 1.568741 0.832487 ] [ 2.312512 2.941662 0.559243 ] [ 2.76942 1.516894 1.016982 ] [ 2.535548 1.814472 2.698768 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.308739e-11 2.525778e-11 2.81745e-10 ] [ 4.737551e-11 1.568741e-10 8.32487e-11 ] [ 2.312512e-10 2.941662e-10 5.592430000000001e-11 ] [ 2.76942e-10 1.516894e-10 1.016982e-10 ] [ 2.535548e-10 1.814472e-10 2.698768e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.5915563 1.4348271 -0.937584 ] [ -1.2743901 -0.4989606 0.6146587 ] [ -6.089704 20.1033444 -5.574993 ] [ 8.9924142 -23.0104781 -5.9120323 ] [ -3.2198763 1.9712671 11.8099507 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.549954294546951e-09 2.298846434510264e-09 -1.502175164836147e-09 ] [ -2.041798023998974e-09 -7.994230080203405e-10 9.84791798911321e-10 ] [ -9.756781376392243e-09 3.220910839757061e-08 -8.932123445723654e-09 ] [ 1.440743579578994e-08 -3.68668500452504e-08 -9.472119932474451e-09 ] [ -5.158810529728008e-09 3.158318060972216e-09 1.892162690434059e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -11.316092 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.813037804122191e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0767952 0.1424792 2.5186798 ] [ 0.4235938 1.8193896 0.9997805 ] [ 2.3720461 3.09526 0.6512912 ] [ 2.6894286 0.7778476 0.924477 ] [ 2.0602452 2.2593704 2.8307016 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0767952e-10 1.424792e-11 2.5186798e-10 ] [ 4.235938e-11 1.8193896e-10 9.997805e-11 ] [ 2.3720461e-10 3.09526e-10 6.512912e-11 ] [ 2.6894286e-10 7.778476e-11 9.24477e-11 ] [ 2.0602452e-10 2.2593704e-10 2.8307016e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5e-06 -1.1e-06 2e-07 ] [ -4.5e-06 8e-07 -4.3e-06 ] [ 3e-06 -4.5e-06 2.8e-06 ] [ -2.8e-06 -2e-07 -3.5e-06 ] [ -6e-07 4.9e-06 4.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.010883104e-15 -1.76239428288e-15 3.2043532416e-16 ] [ -7.2097947936e-15 1.28174129664e-15 -6.889359469440001e-15 ] [ 4.8065298624e-15 -7.2097947936e-15 4.48609453824e-15 ] [ -4.48609453824e-15 -3.2043532416e-16 -5.6076181728e-15 ] [ -9.6130597248e-16 7.850665441919999e-15 7.53023011776e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.115797 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.383123628295878e-18 } }