{ "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" [ [ 2.750115 2.05781 3.008489 ] [ 2.459373 1.512643 5.182306 ] [ 3.045421 4.403069 3.012822 ] [ 1.351279 3.64529 4.777489 ] [ 4.685264 1.369475 1.888704 ] [ 3.677702 3.202643 0.9471066 ] [ 3.576002 3.111527 4.892003 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.750115e-10 2.05781e-10 3.008489e-10 ] [ 2.459373e-10 1.512643e-10 5.182306e-10 ] [ 3.045421e-10 4.403069e-10 3.012822e-10 ] [ 1.351279e-10 3.64529e-10 4.777489e-10 ] [ 4.685264e-10 1.369475e-10 1.888704e-10 ] [ 3.677702e-10 3.202643e-10 9.471066000000001e-11 ] [ 3.576002e-10 3.111527e-10 4.892003e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.731175 -4.822883 -4.6761804 ] [ -1.9744079 -8.4124025 5.0775729 ] [ -0.2889944 4.1745324 -1.6681534 ] [ -5.9050091 4.2058777 -0.2680618 ] [ 1.9646242 -1.6557569 -0.0723111 ] [ 0.6370848 2.2686173 -3.276676 ] [ 9.2978773 4.2420151 4.8838099 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.978001402364949e-09 -7.727110451115822e-09 -7.492066973248772e-09 ] [ -3.163350203365009e-09 -1.347815472130318e-08 8.135168657811617e-09 ] [ -4.630200750368495e-10 6.688338269155942e-09 -2.672676399407655e-09 ] [ -9.460867603577368e-09 6.738558976401661e-09 -4.294823524279811e-10 ] [ 3.147674987830942e-09 -2.652815016764275e-09 -1.158551547988374e-10 ] [ 1.020722380436563e-09 3.634725629548168e-09 -5.249813724388583e-09 ] [ 1.489684175585901e-08 6.796457474295173e-09 7.824726106677876e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.095647 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.89924228005122e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6039346 1.8856419 3.0745041 ] [ 2.2698381 1.3743109 5.5878445 ] [ 2.9665962 4.3947934 2.8775548 ] [ 1.3351717 3.5308661 4.5906017 ] [ 4.5624718 1.4476576 1.8042776 ] [ 3.9158068 3.4709476 0.9210436 ] [ 3.8913367 3.1982395 4.8530934 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6039346e-10 1.8856419e-10 3.0745041e-10 ] [ 2.2698381e-10 1.3743109e-10 5.5878445e-10 ] [ 2.9665962e-10 4.3947934e-10 2.8775548e-10 ] [ 1.3351717e-10 3.5308661e-10 4.5906017e-10 ] [ 4.5624718e-10 1.4476576e-10 1.8042776e-10 ] [ 3.9158068e-10 3.4709476e-10 9.210436e-11 ] [ 3.8913367e-10 3.1982395e-10 4.8530934e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0002068 -0.0001764 0.0003439 ] [ -6.02e-05 -2.8e-05 -3.72e-05 ] [ 4.66e-05 3.18e-05 -0.0001677 ] [ -0.0001057 1.87e-05 3.17e-05 ] [ 0.0001084 4.39e-05 -5.4e-06 ] [ 6.25e-05 0.000181 -0.0002045 ] [ 0.0001551 -7.11e-05 3.91e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.313301279112e-13 -2.826239582376e-13 5.509885444326e-13 ] [ -9.645103336679999e-14 -4.486094575199999e-14 -5.96009707848e-14 ] [ 7.466143114439999e-14 5.09492169612e-14 -2.686850215218e-13 ] [ -1.693500702138e-13 2.99607030558e-14 5.078899929779999e-14 ] [ 1.736759471256e-13 7.03355542326e-14 -8.6517538236e-15 ] [ 1.00136039625e-13 2.89993970754e-13 -3.27645121653e-13 ] [ 2.484975959334e-13 -1.139147586774e-13 6.26451063894e-14 ] ] } "relaxed-potential-energy" { "source-value" -23.460479 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.758783127624769e-18 } }