{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.5286717 0.5459164 0.2171681 ] [ 0.0530602 2.45185 0.0097729 ] [ 0.1982568 1.952172 2.366336 ] [ 2.940741 0.007829 0.5912968 ] [ 2.574768 0.9414562 2.330693 ] [ 2.158325 2.742494 1.504322 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.286717e-11 5.459164e-11 2.171681e-11 ] [ 5.30602e-12 2.45185e-10 9.7729e-13 ] [ 1.982568e-11 1.952172e-10 2.366336e-10 ] [ 2.940741e-10 7.828999999999999e-13 5.912968e-11 ] [ 2.574768e-10 9.414562e-11 2.330693e-10 ] [ 2.158325e-10 2.742494e-10 1.504322e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.8499302 -5.4534376 4.1878671 ] [ -0.5799927 7.6106631 -0.1730744 ] [ -0.172272 -1.7510336 -0.1939732 ] [ -0.2036711 -0.9681828 -5.1686006 ] [ -2.4121844 -2.3688566 6.7056401 ] [ -1.4818101 2.9308475 -5.3578591 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.770444778951869e-09 -8.737370225711662e-09 6.709702758637497e-09 ] [ -9.292507441746682e-10 1.219362648760525e-08 -2.772957573389875e-10 ] [ -2.760101708184576e-10 -2.805465096155259e-09 -3.107793261017626e-10 ] [ -3.263170747526189e-10 -1.551199846820682e-09 -8.281011043572854e-09 ] [ -3.864745450738476e-09 -3.795326662547777e-09 1.074361979571897e-08 ] [ -2.37412149868531e-09 4.695735343630128e-09 -8.584236587560529e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.408703 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.789181694505082e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7567535 0.4681401 0.5913208 ] [ -0.0390813 2.6882644 0.0697791 ] [ 0.2212209 2.0428812 2.3890064 ] [ 3.161102 0.3485187 0.3935853 ] [ 2.1696785 0.6183129 2.5861574 ] [ 2.1841491 2.4756004 0.9897396 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.567535e-11 4.681401e-11 5.913208e-11 ] [ -3.90813e-12 2.6882644e-10 6.97791e-12 ] [ 2.212209e-11 2.0428812e-10 2.3890064e-10 ] [ 3.161102e-10 3.485187e-11 3.935853e-11 ] [ 2.1696785e-10 6.183129e-11 2.5861574e-10 ] [ 2.1841491e-10 2.4756004e-10 9.897396000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.64e-05 3.6e-06 1.15e-05 ] [ 8.5e-06 -1.14e-05 3.9e-06 ] [ 2.3e-06 4.4e-06 -1.21e-05 ] [ 1.1e-05 1.35e-05 -1.58e-05 ] [ -7.8e-06 -3.3e-06 7.9e-06 ] [ 2.4e-06 -6.8e-06 4.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.627569658112e-14 5.76783583488e-15 1.84250311392e-14 ] [ 1.36185012768e-14 -1.826481347712e-14 6.24848882112e-15 ] [ 3.68500622784e-15 7.04957713152e-15 -1.938633711168e-14 ] [ 1.76239428288e-14 2.16293843808e-14 -2.531439060864e-14 ] [ -1.249697764224e-14 -5.28718284864e-15 1.265719530432e-14 ] [ 3.84522388992e-15 -1.089480102144e-14 7.370012455680001e-15 ] ] } "relaxed-potential-energy" { "source-value" -23.902638 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.829624777904567e-18 } }