{ "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" [ [ 2.69276 0.7489354 1.12344 ] [ 2.32609 2.279725 3.013569 ] [ 2.388377 0.2175567 3.770382 ] [ 2.168931 2.205605 5.63033 ] [ 4.69019 0.7206414 2.589749 ] [ 3.957875 2.675588 1.380487 ] [ 4.50812 1.505291 4.661584 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.69276e-10 7.489354e-11 1.12344e-10 ] [ 2.32609e-10 2.279725e-10 3.013569e-10 ] [ 2.388377e-10 2.175567e-11 3.770382e-10 ] [ 2.168931e-10 2.205605e-10 5.63033e-10 ] [ 4.690190000000001e-10 7.206414e-11 2.589749e-10 ] [ 3.957875e-10 2.675588e-10 1.380487e-10 ] [ 4.50812e-10 1.505291e-10 4.661584000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.8951363 -4.0211977 -5.922197 ] [ -7.6819229 7.7458647 1.7773636 ] [ -3.2406883 -5.0562955 2.5481584 ] [ 0.3574936 0.4145414 0.92957 ] [ 8.2819672 -3.8735878 -0.7654135 ] [ 2.642261 3.9680565 -2.0935377 ] [ 2.5360258 0.8226185 3.5260562 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.638519693889415e-09 -6.442668942554733e-09 -9.488405577171897e-09 ] [ -1.230779727316814e-08 1.241024333022001e-08 2.847650406580923e-09 ] [ -5.192155029560097e-09 -8.101078437956247e-09 4.082599814575135e-09 ] [ 5.72767888005627e-10 6.641685394337011e-10 1.489335321397056e-09 ] [ 1.326917422207244e-08 -6.206171811776107e-09 -1.226327614944701e-09 ] [ 4.233368800251629e-09 6.357527354313474e-09 -3.354217157703405e-09 ] [ 4.063161246505617e-09 1.317980128537565e-09 5.64936480726689e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.1867461 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.311661320184558e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1401448 0.6262852 1.2728932 ] [ 2.3812234 3.2936373 3.1597491 ] [ 2.7056042 -0.1871412 3.3493248 ] [ 2.3286747 1.6574569 4.7374251 ] [ 4.884333 0.8515027 2.9940838 ] [ 3.6914465 2.2953271 1.5927147 ] [ 4.6009165 1.8162746 5.0633503 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1401448e-10 6.262852e-11 1.2728932e-10 ] [ 2.3812234e-10 3.2936373e-10 3.1597491e-10 ] [ 2.7056042e-10 -1.871412e-11 3.3493248e-10 ] [ 2.3286747e-10 1.6574569e-10 4.737425100000001e-10 ] [ 4.884333e-10 8.515027e-11 2.9940838e-10 ] [ 3.6914465e-10 2.2953271e-10 1.5927147e-10 ] [ 4.600916500000001e-10 1.8162746e-10 5.0633503e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.2e-06 -1.52e-05 -2.56e-05 ] [ 1.52e-05 -3.77e-05 1.07e-05 ] [ -6e-07 1.1e-05 -1.81e-05 ] [ 1.36e-05 3.96e-05 4.4e-06 ] [ 5e-07 -6.8e-06 -7.2e-06 ] [ -2.87e-05 5.3e-06 8.6e-06 ] [ -3.3e-06 3.7e-06 2.74e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.126965186560001e-15 -2.435308463616e-14 -4.101572149248001e-14 ] [ 2.435308463616e-14 -6.040205860416e-14 1.714328984256e-14 ] [ -9.6130597248e-16 1.76239428288e-14 -2.899939683648e-14 ] [ 2.178960204288e-14 6.344619418368e-14 7.04957713152e-15 ] [ 8.010883104e-16 -1.089480102144e-14 -1.153567166976e-14 ] [ -4.598246901696e-14 8.491536090240001e-15 1.377871893888e-14 ] [ -5.28718284864e-15 5.928053496960001e-15 4.389963940992e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.23956 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.281429012247885e-18 } }