{ "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" [ [ 2.55675 2.192965 3.527099 ] [ 1.806278 5.26626 2.450306 ] [ 0.8031725 3.384297 2.630387 ] [ 2.570894 3.149532 1.167105 ] [ 2.627788 4.286276 4.286712 ] [ 4.842075 2.861339 2.293967 ] [ 3.90768 5.002934 2.246314 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.55675e-10 2.192965e-10 3.527099e-10 ] [ 1.806278e-10 5.26626e-10 2.450306e-10 ] [ 8.031725e-11 3.384297e-10 2.630387e-10 ] [ 2.570894e-10 3.149532e-10 1.167105e-10 ] [ 2.627788e-10 4.286276e-10 4.286712e-10 ] [ 4.842075000000001e-10 2.861339e-10 2.293967e-10 ] [ 3.90768e-10 5.002934e-10 2.246314e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.0653555 -2.577164 0.6352625 ] [ -2.4024693 3.4642263 -0.6776042 ] [ -2.9106939 -1.5970147 -0.2936495 ] [ 0.6304433 -0.941455 -2.4353525 ] [ 0.8741204 1.2186339 3.2020245 ] [ -0.3988945 -0.764255 0.2204557 ] [ 3.1421384 1.1970286 -0.6511366 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.706887674940694e-09 -4.12907190876741e-09 1.01780272557096e-09 ] [ -3.849180144649742e-09 5.550302387020487e-09 -1.085641607395887e-09 ] [ -4.663445716885173e-09 -2.558699615413926e-09 -4.704783636096097e-10 ] [ 1.010081516000001e-09 -1.508377190535264e-09 -3.901864838906832e-09 ] [ 1.400495268644344e-09 1.952466743894325e-09 5.13020879312881e-09 ] [ -6.390994420657056e-10 -1.224471493329504e-09 3.532089684620986e-10 ] [ 5.034260683797918e-09 1.917851237348955e-09 -1.043235837467201e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.930034 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.552272804334911e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6602231 2.5739066 3.7261843 ] [ 1.0713203 5.2311422 2.9324498 ] [ 0.986072 3.0291489 2.2387521 ] [ 2.5646041 2.9505581 0.553729 ] [ 2.9020311 4.7808823 4.2677425 ] [ 4.2619924 2.7039281 2.1014003 ] [ 4.6683944 4.8740369 2.781632 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6602231e-10 2.5739066e-10 3.7261843e-10 ] [ 1.0713203e-10 5.2311422e-10 2.9324498e-10 ] [ 9.86072e-11 3.0291489e-10 2.2387521e-10 ] [ 2.5646041e-10 2.9505581e-10 5.537290000000001e-11 ] [ 2.9020311e-10 4.7808823e-10 4.2677425e-10 ] [ 4.2619924e-10 2.7039281e-10 2.1014003e-10 ] [ 4.668394400000001e-10 4.8740369e-10 2.781632e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.9e-05 2.67e-05 1.23e-05 ] [ 4.5e-06 -2.96e-05 -8.5e-06 ] [ -3.2e-05 1.46e-05 -8.5e-06 ] [ -3e-06 1.13e-05 -5.4e-06 ] [ 6e-07 -2.2e-06 9.6e-06 ] [ 1.94e-05 -3.9e-06 3.1e-06 ] [ -8.5e-06 -1.7e-05 -2.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.04413557952e-14 4.277811577536e-14 1.970677243584e-14 ] [ 7.2097947936e-15 -4.742442797568e-14 -1.36185012768e-14 ] [ -5.12696518656e-14 2.339177866368e-14 -1.36185012768e-14 ] [ -4.8065298624e-15 1.810459581504e-14 -8.65175375232e-15 ] [ 9.6130597248e-16 -3.52478856576e-15 1.538089555968e-14 ] [ 3.108222644352e-14 -6.24848882112e-15 4.96674752448e-15 ] [ -1.36185012768e-14 -2.72370025536e-14 -4.16565921408e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.636824 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.985948369876434e-18 } }