{ "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" [ [ 0.4782146 0.2463157 2.780652 ] [ 1.177721 1.395115 2.585121 ] [ 0.0381624 2.281468 2.997086 ] [ 2.63123 2.94255 0.0860101 ] [ 1.942246 2.110601 1.196975 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.782146e-11 2.463157e-11 2.780652e-10 ] [ 1.177721e-10 1.395115e-10 2.585121e-10 ] [ 3.81624e-12 2.281468e-10 2.997086e-10 ] [ 2.63123e-10 2.94255e-10 8.601010000000001e-12 ] [ 1.942246e-10 2.110601e-10 1.196975e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.434491 -18.3070097 3.2810525 ] [ 11.9823125 4.3711345 0.8539937 ] [ -10.235928 9.2670434 5.2046328 ] [ 5.1953841 5.6742432 -8.0633031 ] [ 1.4927224 -1.0054114 -1.2763759 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.351354428854801e-08 -2.933106293809882e-08 5.256825607117392e-09 ] [ 1.91977809506196e-08 7.003329502272297e-09 1.368248740450489e-09 ] [ -1.63997645337921e-08 1.484744027941894e-08 8.338740992008843e-09 ] [ 8.32392294109605e-09 9.091139795773378e-09 -1.291883571324416e-08 ] [ 2.391604930624466e-09 -1.610846639365797e-09 -2.044979626332559e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 44.030701 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.054495973963519e-18 } "relaxed-configuration-positions" { "source-value" [ [ -1.8069375 -3.4544958 3.907655 ] [ 4.0109655 1.348556 5.6238144 ] [ -2.4238465 4.3781821 3.7698833 ] [ 4.9190446 6.6130415 -2.0803665 ] [ 1.568348 0.090766 -1.5751421 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.8069375e-10 -3.4544958e-10 3.907655e-10 ] [ 4.0109655e-10 1.348556e-10 5.6238144e-10 ] [ -2.4238465e-10 4.3781821e-10 3.7698833e-10 ] [ 4.9190446e-10 6.6130415e-10 -2.0803665e-10 ] [ 1.568348e-10 9.0766e-12 -1.5751421e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 -0.0 0.0 ] [ 0.0 -0.0 0.0 ] [ -0.0 0.0 -0.0 ] [ 0.0 0.0 -0.0 ] [ 0.0 -0.0 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 1.7763568e-15 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.846037335159101e-34 } }