{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.966235 1.459279 2.017921 ] [ 1.582263 2.973277 1.988687 ] [ 1.824476 2.329709 3.996255 ] [ 2.988754 4.654766 3.111716 ] [ 4.721481 3.212435 2.659559 ] [ 3.387912 3.682172 0.4517977 ] [ 4.184602 3.482657 5.105901 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.966235e-10 1.459279e-10 2.017921e-10 ] [ 1.582263e-10 2.973277e-10 1.988687e-10 ] [ 1.824476e-10 2.329709e-10 3.996255e-10 ] [ 2.988754e-10 4.654766e-10 3.111716e-10 ] [ 4.721481e-10 3.212435e-10 2.659559e-10 ] [ 3.387912e-10 3.682172e-10 4.517977e-11 ] [ 4.184602e-10 3.482657e-10 5.105901e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.8138949 -3.6427423 -1.0390815 ] [ -3.4745882 0.6437166 -1.6597054 ] [ -1.8348276 -1.3012632 2.8175618 ] [ -0.5564326 3.4330394 0.6047035 ] [ 3.3462475 -0.2610961 -0.3194764 ] [ 0.6220618 0.9820534 -2.9390761 ] [ 1.0836442 0.1462922 2.5350741 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.304003380568354e-09 -5.83631654865922e-09 -1.664792086405795e-09 ] [ -5.566903980947555e-09 1.031347686940865e-09 -2.659141189295512e-09 ] [ -2.939717883918574e-09 -2.084853476547395e-09 4.514231643619165e-09 ] [ -8.915033027709582e-10 5.50033546496526e-09 9.688418102159327e-10 ] [ 5.361279511910448e-09 -4.183220672020589e-10 -5.118576189773491e-10 ] [ 9.966528726527654e-10 1.573422997857151e-09 -4.708919014172042e-09 ] [ 1.736189402505519e-09 2.343859426453978e-10 4.061636455015602e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 15.541584 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.490036253499935e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.248632 -0.6323812 1.3968878 ] [ -0.8934568 3.2361605 0.8118473 ] [ 0.4569658 1.3169954 5.7860973 ] [ 2.6738636 6.6843834 3.3783647 ] [ 7.209321 3.0978689 2.3395494 ] [ 3.8126427 4.4018343 -1.7850415 ] [ 5.1477547 3.6894338 7.4041318 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.248632e-10 -6.323812e-11 1.3968878e-10 ] [ -8.934568000000001e-11 3.2361605e-10 8.118473000000001e-11 ] [ 4.569658e-11 1.3169954e-10 5.7860973e-10 ] [ 2.6738636e-10 6.6843834e-10 3.3783647e-10 ] [ 7.209321000000001e-10 3.0978689e-10 2.3395494e-10 ] [ 3.8126427e-10 4.4018343e-10 -1.7850415e-10 ] [ 5.1477547e-10 3.6894338e-10 7.4041318e-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 ] [ 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 ] [ 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 } }