{ "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" [ [ 2.625679 2.727046 1.588106 ] [ 1.116882 2.069952 3.236218 ] [ 3.070568 3.395161 4.858531 ] [ 1.593326 4.342716 3.66284 ] [ 4.916804 2.207526 1.823276 ] [ 3.525085 1.533636 3.413768 ] [ 3.625469 4.392152 2.422621 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.625679e-10 2.727046e-10 1.588106e-10 ] [ 1.116882e-10 2.069952e-10 3.236218e-10 ] [ 3.070568e-10 3.395161e-10 4.858531e-10 ] [ 1.593326e-10 4.342716e-10 3.66284e-10 ] [ 4.916804e-10 2.207526e-10 1.823276e-10 ] [ 3.525085e-10 1.533636e-10 3.413768e-10 ] [ 3.625469e-10 4.392152e-10 2.422621e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.7493698 -2.4566778 -5.8372371 ] [ -2.4347995 -1.0921646 0.5996227 ] [ 3.143566 -2.0274298 3.0500473 ] [ -3.0735151 3.1084861 -1.2649957 ] [ 3.6647891 0.0522082 -2.4474376 ] [ -0.3848264 -2.7121173 4.665657 ] [ 1.8341558 5.1276952 1.2343434 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.404976051785254e-09 -3.936031768426525e-09 -9.352284888737921e-09 ] [ -3.900978867374882e-09 -1.749840602601956e-09 9.607014791559916e-10 ] [ 5.036547992636843e-09 -3.248300652635293e-09 4.886714516654788e-09 ] [ -4.924314077466172e-09 4.980343796533787e-09 -2.026746552650474e-09 ] [ 5.871639464557889e-09 8.36467581431988e-11 -3.921227335893038e-09 ] [ -6.165598662263376e-10 -4.345290966727168e-09 7.475206627658538e-09 ] [ 2.938641565875577e-09 8.215473435713956e-09 1.977636153812115e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.308091 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.132191244334569e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7868519 2.8437765 1.0489525 ] [ 0.7885102 2.6536631 2.3605011 ] [ 3.2020962 2.9842488 5.3512747 ] [ 1.7237344 4.1450908 3.9885901 ] [ 4.4364782 1.4732829 1.9380609 ] [ 4.6426793 1.5623696 4.2374438 ] [ 2.8934627 5.0057574 2.080537 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7868519e-10 2.8437765e-10 1.0489525e-10 ] [ 7.885102000000001e-11 2.6536631e-10 2.3605011e-10 ] [ 3.2020962e-10 2.9842488e-10 5.351274700000001e-10 ] [ 1.7237344e-10 4.1450908e-10 3.9885901e-10 ] [ 4.4364782e-10 1.4732829e-10 1.9380609e-10 ] [ 4.6426793e-10 1.5623696e-10 4.2374438e-10 ] [ 2.8934627e-10 5.005757400000001e-10 2.080537e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.54e-05 -4.9e-06 1.5e-06 ] [ -3.74e-05 2e-06 -8.6e-06 ] [ 1.01e-05 -2.93e-05 2.79e-05 ] [ -1.4e-06 9.6e-06 1.3e-05 ] [ -1.51e-05 -6e-06 -5.33e-05 ] [ 5.8e-06 3.37e-05 3.95e-05 ] [ 2.6e-06 -5.2e-06 -2e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.671705284359999e-14 -7.850665506599998e-15 2.403264951e-15 ] [ -5.99214061116e-14 3.204353268e-15 -1.37787190524e-14 ] [ 1.61819840034e-14 -4.69437753762e-14 4.470072808859999e-14 ] [ -2.2430472876e-15 1.53808956864e-14 2.082829624199999e-14 ] [ -2.41928671734e-14 -9.613059803999999e-15 -8.53960145922e-14 ] [ 9.2926244772e-15 5.399335256579999e-14 6.328597704299999e-14 ] [ 4.165659248399999e-15 -8.331318496799998e-15 -3.204353268e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.396455 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.947437034943247e-18 } }