{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.7440121 1.644003 0.1699327 ] [ 1.624629 1.787277 2.54743 ] [ 2.897237 1.241702 0.9240311 ] [ 2.052276 3.648887 1.374272 ] [ 4.460812 2.919724 2.096642 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.440121e-11 1.644003e-10 1.699327e-11 ] [ 1.624629e-10 1.787277e-10 2.54743e-10 ] [ 2.897237e-10 1.241702e-10 9.240311e-11 ] [ 2.052276e-10 3.648887e-10 1.374272e-10 ] [ 4.460812e-10 2.919724e-10 2.096642e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1111827 1.880911 1.3865637 ] [ -1.1991338 -0.0301438 3.075661 ] [ 4.1788175 0.0073817 -2.0595932 ] [ 1.4358464 -0.9001128 -1.6459283 ] [ -4.5267129 -0.9580361 -0.7567032 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.781343225774202e-10 3.013551630005549e-09 2.221519943389945e-09 ] [ -1.921224139571063e-09 -4.829569162207104e-11 4.92775214770635e-09 ] [ 6.695203701089904e-09 1.182678716175936e-11 -3.299832073398659e-09 ] [ 2.300479533139845e-09 -1.442139684242826e-09 -2.637067841773089e-09 ] [ -7.252593577453768e-09 -1.534943041302411e-09 -1.212372175924547e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.298787 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.451135885799897e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7129742 1.7372957 0.4821405 ] [ 1.7908075 1.8142382 2.6454484 ] [ 3.094627 1.343256 0.6235175 ] [ 2.1819437 3.5874574 0.9984237 ] [ 3.9986136 2.7593458 2.3627777 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.129742e-11 1.7372957e-10 4.821405000000001e-11 ] [ 1.7908075e-10 1.8142382e-10 2.6454484e-10 ] [ 3.094627e-10 1.343256e-10 6.235175e-11 ] [ 2.1819437e-10 3.5874574e-10 9.984237000000001e-11 ] [ 3.9986136e-10 2.7593458e-10 2.3627777e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.9e-06 -1.04e-05 3.52e-05 ] [ 1.58e-05 2.74e-05 -6.62e-05 ] [ -1.05e-05 2.82e-05 1.41e-05 ] [ 6.7e-06 -2.72e-05 1.04e-05 ] [ -1.99e-05 -1.81e-05 6.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.265719530432e-14 -1.666263685632e-14 5.639661705216e-14 ] [ 2.531439060864e-14 4.389963940992e-14 -1.0606409229696e-13 ] [ -1.68228545184e-14 4.518138070656001e-14 2.259069035328e-14 ] [ 1.073458335936e-14 -4.357920408576e-14 1.666263685632e-14 ] [ -3.188331475392e-14 -2.899939683648e-14 1.025393037312e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.096417 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.899365623764767e-18 } }