{ "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" [ [ 2.990348 2.100415 1.411886 ] [ 2.946969 3.752547 2.888488 ] [ 5.496135 2.06422 2.457996 ] [ 4.937229 4.674633 2.559339 ] [ 4.468449 3.37128 4.359326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.990348e-10 2.100415e-10 1.411886e-10 ] [ 2.946969e-10 3.752547e-10 2.888488e-10 ] [ 5.496135e-10 2.06422e-10 2.457996e-10 ] [ 4.937229e-10 4.674633e-10 2.559339e-10 ] [ 4.468449e-10 3.37128e-10 4.359326000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.1234448 -1.5571051 -0.6411686 ] [ -4.8539888 0.867169 -0.8991522 ] [ -2.9792883 1.8576848 -0.280448 ] [ 3.1050549 1.0677048 -2.2852609 ] [ 2.6047774 -2.2354534 4.1060297 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.402133614119332e-09 -2.494757387348446e-09 -1.027265340911067e-09 ] [ -7.776947372985046e-09 1.389357898082515e-09 -1.440600633380886e-09 ] [ -4.773346060882977e-09 2.976339155375524e-09 -4.493272289501184e-10 ] [ 4.974846367080481e-09 1.71065166847594e-09 -3.661391586408367e-09 ] [ 4.17331345266821e-09 -3.581591174367871e-09 6.578584789650437e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.651453 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.026986221575002e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.9860611 1.7736946 1.311182 ] [ 2.92359 3.7268058 2.7674246 ] [ 5.1222538 2.3104683 2.3541257 ] [ 5.1878715 4.7952524 2.6697651 ] [ 4.6193535 3.3568739 4.5745375 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9860611e-10 1.7736946e-10 1.311182e-10 ] [ 2.92359e-10 3.7268058e-10 2.7674246e-10 ] [ 5.1222538e-10 2.3104683e-10 2.3541257e-10 ] [ 5.1878715e-10 4.7952524e-10 2.6697651e-10 ] [ 4.6193535e-10 3.3568739e-10 4.5745375e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.6e-06 1.59e-05 1.24e-05 ] [ -2.37e-05 -1.6e-06 1.99e-05 ] [ 3.97e-05 -3.67e-05 -1.5e-06 ] [ 2.41e-05 5.59e-05 -4.4e-05 ] [ -3.66e-05 -3.35e-05 1.32e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.76783583488e-15 2.547460827072e-14 1.986699009792e-14 ] [ -3.797158591296e-14 -2.56348259328e-15 3.188331475392e-14 ] [ 6.360641184576e-14 -5.879988198335999e-14 -2.4032649312e-15 ] [ 3.861245656128e-14 8.956167310272e-14 -7.04957713152e-14 ] [ -5.863966432128e-14 -5.36729167968e-14 2.114873139456e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.797586 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.370834633347739e-18 } }