{ "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" [ [ 0.7607129 0.1029019 2.480933 ] [ 0.9158836 2.552597 0.2381701 ] [ 0.8989231 2.268448 2.632769 ] [ 2.109562 0.2713555 0.0459784 ] [ 2.969591 1.985029 0.1686784 ] [ 2.973458 2.362165 2.304699 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.607129000000001e-11 1.029019e-11 2.480933e-10 ] [ 9.158836e-11 2.552597e-10 2.381701e-11 ] [ 8.989231e-11 2.268448e-10 2.632769e-10 ] [ 2.109562e-10 2.713555e-11 4.59784e-12 ] [ 2.969591e-10 1.985029e-10 1.686784e-11 ] [ 2.973458e-10 2.362165e-10 2.304699e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.4291852 -2.7655082 -0.0149595 ] [ -4.2544653 2.4849719 -2.5848541 ] [ -3.3856063 1.8646774 2.3592308 ] [ -1.7347942 -6.044721 -1.2989877 ] [ 4.6508034 2.6218828 -2.6665393 ] [ 5.1532476 1.8386972 4.2061098 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.876304934333722e-10 -4.430832582670691e-09 -2.39677611588576e-11 ] [ -6.816404837664858e-09 3.981363881524956e-09 -4.141392807199025e-09 ] [ -5.424339261093191e-09 2.98754253561413e-09 3.779904430831281e-09 ] [ -2.77944670913944e-09 -9.684710665458796e-09 -2.081207723646765e-09 ] [ 7.451408475417151e-09 4.200719324637642e-09 -4.272266924904398e-09 ] [ 8.256412825913711e-09 2.945917666570421e-09 6.738930786077765e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.958567 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.07619130864704e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.713349 -0.0849224 2.1716158 ] [ 0.7348161 3.091121 0.3057792 ] [ 0.8158308 2.2445997 2.6047304 ] [ 2.2251766 -0.2775074 0.3268772 ] [ 2.904612 1.9785187 0.0558573 ] [ 3.2343462 2.5906869 2.406368 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.13349e-11 -8.49224e-12 2.1716158e-10 ] [ 7.348161e-11 3.091121e-10 3.057792e-11 ] [ 8.158308e-11 2.2445997e-10 2.6047304e-10 ] [ 2.2251766e-10 -2.775074e-11 3.268772e-11 ] [ 2.904612e-10 1.9785187e-10 5.58573e-12 ] [ 3.2343462e-10 2.5906869e-10 2.406368e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.12e-05 -4.71e-05 3.45e-05 ] [ 0.0001038 1e-05 4.95e-05 ] [ 7.3e-06 1.41e-05 -5.25e-05 ] [ -4.31e-05 -6.84e-05 2.4e-06 ] [ -1.42e-05 9.32e-05 4.57e-05 ] [ -8.52e-05 -1.8e-06 -7.95e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.998791056896e-14 -7.546251883968001e-14 5.52750934176e-14 ] [ 1.6630593323904e-13 1.6021766208e-14 7.930774272959999e-14 ] [ 1.169588933184e-14 2.259069035328e-14 -8.4114272592e-14 ] [ -6.905381235648e-14 -1.0958888086272e-13 3.84522388992e-15 ] [ -2.275090801536e-14 1.4932286105856e-13 7.321947157056e-14 ] [ -1.3650544809216e-13 -2.88391791744e-15 -1.273730413536e-13 ] ] } "relaxed-potential-energy" { "source-value" -17.186062 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.753510674001929e-18 } }