{ "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" [ [ 1.26541 0.4689135 1.770405 ] [ 0.1075881 2.160004 0.6716672 ] [ 0.5668509 2.899878 2.242644 ] [ 2.824031 1.222886 2.646945 ] [ 2.932592 2.399832 0.52394 ] [ 1.820297 2.092873 2.325497 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.26541e-10 4.689135e-11 1.770405e-10 ] [ 1.075881e-11 2.160004e-10 6.716672e-11 ] [ 5.668509000000001e-11 2.899878e-10 2.242644e-10 ] [ 2.824031e-10 1.222886e-10 2.646945e-10 ] [ 2.932592e-10 2.399832e-10 5.2394e-11 ] [ 1.820297e-10 2.092873e-10 2.325497e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.7788375 -13.4363542 -5.1742749 ] [ -3.856356 -2.3770352 -8.7495225 ] [ -17.1383793 16.6047558 6.3259334 ] [ 29.9681858 -18.8249158 11.5756306 ] [ 2.5755428 1.2973888 -3.9892665 ] [ -3.7701559 16.7361606 0.0115 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.246307157950232e-08 -2.152741256802789e-08 -8.290102274372258e-09 ] [ -6.178563424681804e-09 -3.808430224258652e-09 -1.401828039266357e-08 ] [ -2.745871063286267e-08 2.66037515368532e-08 1.013526259821786e-08 ] [ 4.801432665655054e-08 -3.016083998328853e-08 1.854620471833708e-08 ] [ 4.126474460029771e-09 2.078646003447767e-09 -6.391509520440643e-09 ] [ -6.040455639751183e-09 2.68142852352741e-08 1.84250311392e-11 ] ] } "unrelaxed-potential-energy" { "source-value" 3.0530346 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.89150065861348e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.6485748 0.3374397 1.9452962 ] [ 0.5941989 1.9640804 0.1770337 ] [ 0.1061684 2.6269164 2.4349422 ] [ 2.9215313 0.799951 2.3008385 ] [ 2.8671656 2.4265606 0.5325502 ] [ 2.3791301 3.0894385 2.7904374 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.485748e-11 3.374397e-11 1.9452962e-10 ] [ 5.941989e-11 1.9640804e-10 1.770337e-11 ] [ 1.061684e-11 2.6269164e-10 2.4349422e-10 ] [ 2.9215313e-10 7.99951e-11 2.3008385e-10 ] [ 2.8671656e-10 2.4265606e-10 5.325502e-11 ] [ 2.3791301e-10 3.0894385e-10 2.7904374e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.19e-05 4.58e-05 -7.7e-06 ] [ -3.9e-06 -4.4e-06 2.51e-05 ] [ -3.3e-06 1e-07 -1.94e-05 ] [ 1.74e-05 -2.29e-05 6e-06 ] [ -1.03e-05 -6.8e-06 -1.68e-05 ] [ -2.18e-05 -1.18e-05 1.28e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.508766799552e-14 7.337968923264e-14 -1.233675998016e-14 ] [ -6.24848882112e-15 -7.04957713152e-15 4.021463318208e-14 ] [ -5.28718284864e-15 1.6021766208e-16 -3.108222644352e-14 ] [ 2.787787320192e-14 -3.668984461632e-14 9.6130597248e-15 ] [ -1.650241919424e-14 -1.089480102144e-14 -2.691656722944e-14 ] [ -3.492745033344e-14 -1.890568412544e-14 2.050786074624e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.411418 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.27026967169763e-18 } }