{ "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" [ [ 2.146488 0.2959799 2.352543 ] [ 2.393537 2.53814 1.109639 ] [ 1.99319 1.640865 4.12466 ] [ 3.097066 3.51077 3.500726 ] [ 3.970578 1.750203 2.795194 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.146488e-10 2.959799e-11 2.352543e-10 ] [ 2.393537e-10 2.53814e-10 1.109639e-10 ] [ 1.99319e-10 1.640865e-10 4.12466e-10 ] [ 3.097066e-10 3.51077e-10 3.500726e-10 ] [ 3.970578e-10 1.750203e-10 2.795194e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.1235264 -6.0649225 -3.2306166 ] [ -1.9402512 2.3571048 -7.3413992 ] [ -7.539162 -2.2636679 10.4518851 ] [ -0.4341672 10.015224 2.8385837 ] [ 13.0371068 -4.0437384 -2.718453 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.00444097253159e-09 -9.717077036463888e-09 -5.176018387288386e-09 ] [ -3.108625111119145e-09 3.77649820333546e-09 -1.176221816219982e-08 ] [ -1.207906909682377e-08 -3.626795786635433e-09 1.674576595050787e-08 ] [ -6.956125373581977e-10 1.604615774487506e-08 4.547912440323961e-09 ] [ 2.08877477178327e-08 -6.478783125111198e-09 -4.355441841343622e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.0604767 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.107777458843135e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.3495037 0.431761 2.25535 ] [ 1.9947145 2.6667952 1.2001757 ] [ 1.6276906 1.6959398 4.2840142 ] [ 3.0908225 3.462626 3.2977563 ] [ 4.5381276 1.478836 2.8454657 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3495037e-10 4.31761e-11 2.25535e-10 ] [ 1.9947145e-10 2.6667952e-10 1.2001757e-10 ] [ 1.6276906e-10 1.6959398e-10 4.2840142e-10 ] [ 3.0908225e-10 3.462626000000001e-10 3.2977563e-10 ] [ 4.5381276e-10 1.478836e-10 2.8454657e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.08e-05 1.5e-05 4.8e-06 ] [ -2.34e-05 -3.5e-06 2.13e-05 ] [ -1.13e-05 1.06e-05 -2.47e-05 ] [ 1.63e-05 -2.43e-05 -6.9e-06 ] [ -2.4e-06 2.1e-06 5.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.332527371264e-14 2.4032649312e-14 7.69044777984e-15 ] [ -3.749093292672001e-14 -5.6076181728e-15 3.412636202304e-14 ] [ -1.810459581504e-14 1.698307218048e-14 -3.957376253376001e-14 ] [ 2.611547891904e-14 -3.893289188544e-14 -1.105501868352e-14 ] [ -3.84522388992e-15 3.36457090368e-15 8.8119714144e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.458486 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.835851837896411e-18 } }