{ "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" [ [ -14.9903267 -9.0691498 -16.8503867 ] [ 3.8797152 6.4554459 22.8064252 ] [ -20.0663889 -47.27829 -34.1147764 ] [ 91.3676553 -1.8740322 -16.6695476 ] [ -60.1906549 51.7660261 44.8282855 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.401715117476632e-08 -1.453037989980577e-08 -2.699729584460437e-08 ] [ 6.215989040014636e-09 1.03427645830311e-08 3.653992156050877e-08 ] [ -3.214989942433696e-08 -7.574817153347585e-08 -5.465789762221463e-08 ] [ 1.463871224250262e-07 -3.002530602203615e-09 -2.670755966407078e-08 ] [ -9.64360608659376e-08 8.293831745245415e-08 7.182283157038099e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 39.18742 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.278516867074428e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.0345528 0.1134759 1.2052163 ] [ 0.0491016 1.6853382 2.91583 ] [ 1.8072597 0.5868092 -0.2197879 ] [ 2.9174501 2.4511781 0.6101386 ] [ 1.8308647 3.1300734 2.5480785 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.45528e-12 1.134759e-11 1.2052163e-10 ] [ 4.91016e-12 1.6853382e-10 2.91583e-10 ] [ 1.8072597e-10 5.868092e-11 -2.197879e-11 ] [ 2.9174501e-10 2.4511781e-10 6.101386e-11 ] [ 1.8308647e-10 3.1300734e-10 2.5480785e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.8e-05 -5.7e-06 -3.35e-05 ] [ 4.68e-05 9.1e-06 2.01e-05 ] [ 7.7e-06 -1.71e-05 -1.26e-05 ] [ -1.84e-05 -1.37e-05 2.84e-05 ] [ -1.81e-05 2.75e-05 -2.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.8839179412e-14 -9.1324068138e-15 -5.367291723899999e-14 ] [ 7.498186647119999e-14 1.45798073694e-14 3.22037503434e-14 ] [ 1.23367600818e-14 -2.73972204414e-14 -2.01874255884e-14 ] [ -2.94800500656e-14 -2.19498198858e-14 4.550181640559999e-14 ] [ -2.899939707539999e-14 4.4059857435e-14 -3.685006258199999e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.435336 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.992360477513902e-18 } }