{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.1599497e-10 2.8268361e-10 2.4414355e-10 ] [ 2.6637835e-10 2.2190638e-10 7.596418000000001e-11 ] [ 2.2418321e-10 1.8078281e-10 4.153167e-10 ] [ 2.3227606e-10 4.8510503e-10 2.5435285e-10 ] [ 4.3993094e-10 2.371173e-10 3.729978e-10 ] [ 4.1833956e-10 3.6191936e-10 1.8501241e-10 ] ] "source-value" [ [ 1.1599497 2.8268361 2.4414355 ] [ 2.6637835 2.2190638 0.7596418 ] [ 2.2418321 1.8078281 4.153167 ] [ 2.3227606 4.8510503 2.5435285 ] [ 4.3993094 2.371173 3.729978 ] [ 4.1833956 3.6191936 1.8501241 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -2.71264523667648e-12 -7.5991237124544e-13 3.41552012022144e-12 ] [ -7.5286279411392e-13 -2.16838583859072e-12 -3.6641779317696e-13 ] [ -1.05551395778304e-12 -1.345828361472e-13 -2.68909324035072e-12 ] [ 1.63470080620224e-12 -2.15765125523136e-12 1.27565302548096e-12 ] [ -2.67211016817024e-12 2.75846748803136e-12 -8.3809859034048e-13 ] [ 5.55843135054144e-12 2.46190459552128e-12 -7.975635218342399e-13 ] ] "source-value" [ [ -0.0016931 -0.0004743 0.0021318 ] [ -0.0004699 -0.0013534 -0.0002287 ] [ -0.0006588 -8.4e-05 -0.0016784 ] [ 0.0010203 -0.0013467 0.0007962 ] [ -0.0016678 0.0017217 -0.0005231 ] [ 0.0034693 0.0015366 -0.0004978 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.83190103056718e-18 "source-value" -11.433827 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -7.809720376416497e-09 -3.50616246145489e-09 4.033093998951374e-09 ] [ -4.320208535493272e-09 -9.794789331714495e-09 -1.259318306113619e-08 ] [ 4.000088679909907e-10 1.202802855621494e-09 -8.569406680540742e-10 ] [ -5.897310611524765e-09 1.45301642873375e-08 8.741369899427828e-10 ] [ 8.077333219130018e-09 -6.893998411627864e-09 1.410699803912245e-08 ] [ 9.549897436313527e-09 4.461983061838256e-09 -5.564105298826341e-09 ] ] "source-value" [ [ -4.8744441 -2.1883745 2.5172593 ] [ -2.6964621 -6.1134267 -7.8600467 ] [ 0.2496659 0.7507305 -0.5348603 ] [ -3.6808118 9.0690153 0.5455934 ] [ 5.0414749 -4.3028954 8.8048957 ] [ 5.9605772 2.7849508 -3.4728414 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -8.025414365297671e-19 "source-value" -5.0090697 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.331987e-10 2.725643e-10 2.897481e-10 ] [ 2.736578e-10 2.541304e-10 1.125105e-10 ] [ 1.73273e-10 1.005545e-10 4.481047e-10 ] [ 2.473311e-10 4.730527000000001e-10 2.221702e-10 ] [ 3.99816e-10 2.852734e-10 3.21894e-10 ] [ 4.698265e-10 3.839392e-10 1.5336e-10 ] ] "source-value" [ [ 1.331987 2.725643 2.897481 ] [ 2.736578 2.541304 1.125105 ] [ 1.73273 1.005545 4.481047 ] [ 2.473311 4.730527 2.221702 ] [ 3.99816 2.852734 3.21894 ] [ 4.698265 3.839392 1.5336 ] ] } "instance-id" 1 }