{ "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" [ [ 2.180035 1.415878 2.755479 ] [ 0.3300308 2.592052 2.653614 ] [ 2.100058 3.620481 1.423788 ] [ 2.171562 4.236408 3.751897 ] [ 3.719666 3.140383 2.648489 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.180035e-10 1.415878e-10 2.755479e-10 ] [ 3.300308e-11 2.592052e-10 2.653614e-10 ] [ 2.100058e-10 3.620481e-10 1.423788e-10 ] [ 2.171562e-10 4.236408e-10 3.751897e-10 ] [ 3.719666e-10 3.140383e-10 2.648489e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 24.4657813 -23.5010858 3.1316224 ] [ -27.3584782 17.3203727 2.3255675 ] [ -41.1778464 13.0024839 -55.7835672 ] [ -16.8165952 14.0849703 27.9637398 ] [ 60.8871385 -20.9067412 22.3626375 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.919850313141414e-08 -3.765289054238919e-08 5.017412235791001e-09 ] [ -4.383311451383837e-08 2.775029643211149e-08 3.725969909289794e-09 ] [ -6.5974183340521e-08 2.083227588854119e-08 -8.93751279290088e-08 ] [ -2.694315589287655e-08 2.256661030524397e-08 4.480285050681582e-08 ] [ 9.75519506158218e-08 -3.349629224372512e-08 3.582889527711217e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 2.3857307 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.822361982556463e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.3121127 0.8543319 2.9502147 ] [ 0.4839925 2.6206574 2.7001724 ] [ 1.9726813 4.1043536 1.1063364 ] [ 1.9722318 4.488146 3.820657 ] [ 3.7603336 2.9377132 2.6558865 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3121127e-10 8.543319e-11 2.9502147e-10 ] [ 4.839925e-11 2.6206574e-10 2.7001724e-10 ] [ 1.9726813e-10 4.1043536e-10 1.1063364e-10 ] [ 1.9722318e-10 4.488146e-10 3.820657e-10 ] [ 3.7603336e-10 2.9377132e-10 2.6558865e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7e-07 3.9e-06 1.1e-06 ] [ 3.61e-05 1.1e-05 -6.4e-06 ] [ -8e-06 -3.2e-06 1.78e-05 ] [ -1.65e-05 6.6e-06 -4.1e-06 ] [ -1.22e-05 -1.83e-05 -8.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.1215236438e-15 6.248488872599999e-15 1.7623942974e-15 ] [ 5.783857648740001e-14 1.7623942974e-14 -1.02539304576e-14 ] [ -1.2817413072e-14 -5.1269652288e-15 2.851874408519999e-14 ] [ -2.6435914461e-14 1.05743657844e-14 -6.568924199399999e-15 ] [ -1.95465549348e-14 -2.93198324022e-14 -1.34582837256e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.556674 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.652671621955531e-18 } }