{ "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" [ [ 1.30949 2.712734 2.978333 ] [ 0.0672006 1.690783 1.932827 ] [ 2.539316 0.8650755 1.245634 ] [ 2.964133 0.3086468 2.850804 ] [ 2.353048 2.858216 0.4219119 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.30949e-10 2.712734e-10 2.978333e-10 ] [ 6.72006e-12 1.690783e-10 1.932827e-10 ] [ 2.539316e-10 8.650755e-11 1.245634e-10 ] [ 2.964133e-10 3.086468e-11 2.850804e-10 ] [ 2.353048e-10 2.858216e-10 4.219119e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 124.9861103 103.9265377 103.8901285 ] [ -121.0217665 -104.5381628 -106.0617366 ] [ -114.0513463 107.5756653 -412.1272565 ] [ 111.5470005 -138.3075732 419.5702426 ] [ -1.459998 31.343533 -5.2713779 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.002498238473901e-07 1.665086689836298e-07 1.664503350146078e-07 ] [ -1.938982448942166e-07 -1.674886004195443e-07 -1.699296347419677e-07 ] [ -1.827304006126246e-07 1.723552159106658e-07 -6.603006551587449e-07 ] [ 1.787179963214659e-07 -2.215931602606247e-07 6.722256334771041e-07 ] [ -2.339174662014758e-09 5.021787578587329e-08 -8.4456784307818e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 101.31216 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.62319974154749e-17 } "relaxed-configuration-positions" { "source-value" [ [ 1.6054041 2.6464133 2.894565 ] [ -0.2762007 1.255591 1.7886587 ] [ 2.0878128 0.7277458 0.8772471 ] [ 3.1177182 0.5759554 3.2466593 ] [ 2.6984533 3.2297498 0.6223798 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6054041e-10 2.6464133e-10 2.894565e-10 ] [ -2.762007e-11 1.255591e-10 1.7886587e-10 ] [ 2.0878128e-10 7.277458e-11 8.772471e-11 ] [ 3.1177182e-10 5.759554e-11 3.2466593e-10 ] [ 2.6984533e-10 3.2297498e-10 6.223798000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.25e-05 -3.11e-05 -4.22e-05 ] [ 3.05e-05 1e-07 7.2e-06 ] [ 2.7e-06 4.31e-05 3.45e-05 ] [ -3.1e-05 -1.24e-05 6.1e-06 ] [ -2.48e-05 2e-07 -5.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.604897396800001e-14 -4.982769290688e-14 -6.761185339776e-14 ] [ 4.88663869344e-14 1.6021766208e-16 1.153567166976e-14 ] [ 4.32587687616e-15 6.905381235648e-14 5.52750934176e-14 ] [ -4.96674752448e-14 -1.986699009792e-14 9.77327738688e-15 ] [ -3.973398019584e-14 3.2043532416e-16 -8.8119714144e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.289176 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.609813695929646e-18 } }