{ "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" [ [ 2.638378 0.8784031 3.89936 ] [ 3.076863 3.046669 3.275657 ] [ 5.153788 2.352253 2.384418 ] [ 4.273122 0.1786437 2.239865 ] [ 4.529593 1.652308 4.599133 ] [ 5.775659 4.557099 1.971672 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.638378e-10 8.784031e-11 3.89936e-10 ] [ 3.076863e-10 3.046669e-10 3.275657e-10 ] [ 5.153788e-10 2.352253e-10 2.384418e-10 ] [ 4.273122e-10 1.786437e-11 2.239865e-10 ] [ 4.529593e-10 1.652308e-10 4.599133e-10 ] [ 5.775659e-10 4.557099e-10 1.971672e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.7563507 -8.9098703 -1.6685172 ] [ -4.3251376 8.8200448 -1.8633996 ] [ 3.7482562 0.3453486 -2.1846133 ] [ 0.1301881 -3.6422852 -2.970236 ] [ 12.1737833 3.0680245 8.6827957 ] [ 0.0292607 0.3187375 0.0039704 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.883575039264954e-08 -1.427518600663057e-08 -2.673259271267104e-09 ] [ -6.929634401554837e-09 1.41312696893932e-08 -2.985495298924946e-09 ] [ 6.005368501885631e-09 5.533094575046124e-10 -3.500136383585632e-09 ] [ 2.085843318448554e-10 -5.835584241804016e-09 -4.758842716665623e-09 ] [ 1.950455115063941e-08 4.915517166439532e-09 1.391137238833567e-08 ] [ 4.68808098344838e-11 5.10673774879575e-10 6.3612821076336e-12 ] ] } "unrelaxed-potential-energy" { "source-value" -9.3859474 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.503794561223305e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.736011 1.0036053 3.5016177 ] [ 3.0549255 3.5233849 3.5935468 ] [ 6.1457576 1.8705319 3.0430916 ] [ 4.3100286 0.8739396 1.5952129 ] [ 4.5717411 2.0001931 4.9494977 ] [ 4.628939 3.393721 1.6871383 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.736011e-10 1.0036053e-10 3.5016177e-10 ] [ 3.0549255e-10 3.5233849e-10 3.5935468e-10 ] [ 6.1457576e-10 1.8705319e-10 3.0430916e-10 ] [ 4.3100286e-10 8.739396e-11 1.5952129e-10 ] [ 4.5717411e-10 2.0001931e-10 4.9494977e-10 ] [ 4.628939e-10 3.393721e-10 1.6871383e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.8e-06 -4.7e-06 2e-06 ] [ -2.2e-06 2e-06 -6.3e-06 ] [ -1.09e-05 1e-06 -7.6e-06 ] [ 2.1e-06 1.4e-05 3.9e-06 ] [ 2.8e-06 2e-07 0.0 ] [ 6.4e-06 -1.25e-05 7.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.8839179412e-15 -7.530230179799999e-15 3.204353268e-15 ] [ -3.5247885948e-15 3.204353268e-15 -1.00937127942e-14 ] [ -1.74637253106e-14 1.602176634e-15 -1.21765424184e-14 ] [ 3.364570931399999e-15 2.243047287599999e-14 6.248488872599999e-15 ] [ 4.486094575199999e-15 3.204353268e-16 0.0 ] [ 1.02539304576e-14 -2.0027207925e-14 1.26571954086e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.599118 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.659471900460881e-18 } }