{ "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" [ [ 2.700341 1.969723 2.203994 ] [ 1.820171 2.226461 4.644887 ] [ 1.683397 4.142957 3.874532 ] [ 4.686676 2.237231 1.35428 ] [ 4.257123 2.593073 3.820407 ] [ 3.357584 4.187851 2.029918 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.700341e-10 1.969723e-10 2.203994e-10 ] [ 1.820171e-10 2.226461e-10 4.644887e-10 ] [ 1.683397e-10 4.142957e-10 3.874532e-10 ] [ 4.686676000000001e-10 2.237231e-10 1.35428e-10 ] [ 4.257123e-10 2.593073e-10 3.820407e-10 ] [ 3.357584e-10 4.187851e-10 2.029918e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.5743619 -3.7198345 -1.9354279 ] [ -0.6515806 -2.1759331 1.7589308 ] [ -2.9122601 4.7650081 0.6022112 ] [ 3.3372479 -1.3693693 -3.1046638 ] [ 3.8290183 -1.6561109 4.050747 ] [ -1.0280637 4.1562395 -1.3717973 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.124582449658267e-09 -5.959831869145258e-09 -3.10089733262404e-09 ] [ -1.043947203886836e-09 -3.486229141244868e-09 2.81811780536504e-09 ] [ -4.665955045908671e-09 7.634384575742628e-09 9.648487054239129e-10 ] [ 5.346860563193896e-09 -2.193971477701262e-09 -4.974219755804087e-09 ] [ 6.134763600875361e-09 -2.653382165432047e-09 6.490012140175738e-09 ] [ -1.647139624833145e-09 6.659029757345481e-09 -2.197861562536564e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.238455 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.800598985491286e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3496309 1.1870734 2.044951 ] [ 2.1782646 2.17393 4.2821551 ] [ 1.7332012 4.4262167 3.6872602 ] [ 4.3274387 2.6156943 1.809006 ] [ 4.6280706 2.2084343 4.2073616 ] [ 3.288686 4.7459472 1.8972841 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3496309e-10 1.1870734e-10 2.044951e-10 ] [ 2.1782646e-10 2.17393e-10 4.2821551e-10 ] [ 1.7332012e-10 4.426216700000001e-10 3.6872602e-10 ] [ 4.3274387e-10 2.6156943e-10 1.809006e-10 ] [ 4.6280706e-10 2.2084343e-10 4.2073616e-10 ] [ 3.288686e-10 4.7459472e-10 1.8972841e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 -3.93e-05 -1.86e-05 ] [ -4.21e-05 2.1e-05 3e-07 ] [ 2.37e-05 2.7e-06 -9.7e-06 ] [ -1.49e-05 1.05e-05 -2.96e-05 ] [ 3.63e-05 1.5e-05 1.93e-05 ] [ -3e-06 -9.9e-06 3.84e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 -6.296554119743999e-14 -2.980048514688e-14 ] [ -6.745163573568001e-14 3.36457090368e-14 4.8065298624e-16 ] [ 3.797158591296e-14 4.32587687616e-15 -1.554111322176e-14 ] [ -2.387243164992e-14 1.68228545184e-14 -4.742442797568e-14 ] [ 5.815901133504e-14 2.4032649312e-14 3.092200878144e-14 ] [ -4.8065298624e-15 -1.586154854592e-14 6.152358223872e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.186062 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.753510674001929e-18 } }