{ "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" [ [ 0.1501776 0.7389508 1.254214 ] [ 0.5251994 1.126951 2.894489 ] [ 1.795844 1.050789 0.3566565 ] [ 2.560887 2.159455 0.963327 ] [ 1.607121 2.890729 1.590789 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.501776e-11 7.389508e-11 1.254214e-10 ] [ 5.251994e-11 1.126951e-10 2.894489e-10 ] [ 1.795844e-10 1.050789e-10 3.566565e-11 ] [ 2.560887e-10 2.159455e-10 9.633270000000001e-11 ] [ 1.607121e-10 2.890729e-10 1.590789e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -47.5259813 -32.8097189 -12.0615658 ] [ -16.8892808 -5.4770646 50.557334 ] [ -5.6384878 -56.9166097 -59.6523922 ] [ 116.9346195 14.6066856 -25.2179843 ] [ -46.8808697 80.5967076 46.3746084 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.614501611943799e-08 -5.256696455659989e-08 -1.932475873500085e-08 ] [ -2.705961083988633e-08 -8.775224852731305e-09 8.100177854477694e-08 ] [ -9.033853329826026e-09 -9.119046139653852e-08 -9.55736681576323e-08 ] [ 1.873499135250438e-07 2.340249017569602e-08 -4.040366486916145e-08 ] [ -7.51114333961111e-08 1.291301606301737e-07 7.43003133772353e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 66.435761 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.064418230592564e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.0326317 0.0790489 1.2321146 ] [ 0.0292067 1.7070391 2.9296899 ] [ 1.8261006 0.5437076 -0.2169151 ] [ 2.9309921 2.4589767 0.5850096 ] [ 1.8202979 3.1781026 2.5295766 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.26317e-12 7.90489e-12 1.2321146e-10 ] [ 2.92067e-12 1.7070391e-10 2.9296899e-10 ] [ 1.8261006e-10 5.437075999999999e-11 -2.169151e-11 ] [ 2.9309921e-10 2.4589767e-10 5.850096e-11 ] [ 1.8202979e-10 3.1781026e-10 2.5295766e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.4e-06 -1.09e-05 9.2e-06 ] [ -1.52e-05 1.45e-05 -1.13e-05 ] [ -0.0 -5e-06 -6.8e-06 ] [ -3.8e-06 1.06e-05 -9.6e-06 ] [ 1.26e-05 -9.3e-06 1.85e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.025393037312e-14 -1.746372516672e-14 1.474002491136e-14 ] [ -2.435308463616e-14 2.32315610016e-14 -1.810459581504e-14 ] [ 0.0 -8.010883104e-15 -1.089480102144e-14 ] [ -6.08827115904e-15 1.698307218048e-14 -1.538089555968e-14 ] [ 2.018742542208e-14 -1.490024257344e-14 2.96402674848e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.566682 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.853186748062819e-18 } }