{ "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" [ [ 2.791974 1.969692 5.430326 ] [ 0.9772327 1.558703 3.532753 ] [ 1.904195 3.961743 3.08361 ] [ 3.942728 2.452708 3.176311 ] [ 3.885409 4.511937 2.468279 ] [ 3.646129 3.851026 4.717011 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.791974e-10 1.969692e-10 5.430326e-10 ] [ 9.772327e-11 1.558703e-10 3.532753e-10 ] [ 1.904195e-10 3.961743e-10 3.08361e-10 ] [ 3.942728e-10 2.452708e-10 3.176311e-10 ] [ 3.885409e-10 4.511937e-10 2.468279e-10 ] [ 3.646129e-10 3.851026e-10 4.717011000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7237828 -1.2624615 1.2039411 ] [ 0.0 0.0 0.0 ] [ -7.2179105 0.1019644 -3.1046919 ] [ 1.6932317 -6.4609911 -3.1931639 ] [ 3.4708111 6.2870015 -10.7529081 ] [ 2.7776505 1.3344866 15.8468228 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.159627880697162e-09 -2.022686299960099e-09 1.928926283240235e-09 ] [ 0.0 0.0 0.0 ] [ -1.156436745412684e-08 1.633649778338995e-10 -4.974264776967132e-09 ] [ 2.712856243337439e-09 -1.035164888761688e-08 -5.11601254696255e-09 ] [ 5.560852399633131e-09 1.007288681823453e-08 -1.722805796343095e-08 ] [ 4.45028669185343e-09 2.138083231290881e-09 2.53894090041204e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -5.6346731 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.02774150667066e-19 } "relaxed-configuration-positions" { "source-value" [ [ 3.3168659 1.25239 7.2036907 ] [ 0.9772327 1.558703 3.532753 ] [ 1.5106098 5.6108093 0.9289268 ] [ 4.0986419 3.2655552 3.4687801 ] [ 3.124943 4.498516 1.9270508 ] [ 4.1193743 2.1198354 5.3470886 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.3168659e-10 1.25239e-10 7.203690700000001e-10 ] [ 9.772327e-11 1.558703e-10 3.532753e-10 ] [ 1.5106098e-10 5.6108093e-10 9.289268000000001e-11 ] [ 4.0986419e-10 3.2655552e-10 3.4687801e-10 ] [ 3.124943e-10 4.498516e-10 1.9270508e-10 ] [ 4.1193743e-10 2.1198354e-10 5.3470886e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0474069 0.0058843 -0.0348783 ] [ 0.0 0.0 0.0 ] [ -0.0395455 0.0480636 -0.0592524 ] [ -0.0312779 0.0773734 -0.1134458 ] [ 0.0509203 -0.0380371 0.037794 ] [ -0.0275038 -0.0932842 0.1697825 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.595422684460352e-11 9.427687889773441e-12 -5.588119683324864e-11 ] [ 0.0 0.0 0.0 ] [ -6.33588755578464e-11 7.700637623148288e-11 -9.493281000628992e-11 ] [ -5.011272012772031e-11 1.239658525518067e-10 -1.817602084879526e-10 ] [ 8.158331418412225e-11 -6.094215234303167e-11 6.05526632065152e-11 ] [ -4.406594534315904e-11 -1.494577643300314e-10 2.72021552120976e-10 ] ] } "relaxed-potential-energy" { "source-value" -11.155491 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.787306687374481e-18 } }