{ "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" [ [ 0.1724043 0.1217148 2.355607 ] [ 0.0803944 1.628444 0.6781111 ] [ 0.0194903 2.198586 2.964695 ] [ 2.614645 0.684385 2.185781 ] [ 2.191382 2.601245 1.67848 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.724043e-11 1.217148e-11 2.355607e-10 ] [ 8.03944e-12 1.628444e-10 6.781111e-11 ] [ 1.94903e-12 2.198586e-10 2.964695e-10 ] [ 2.614645e-10 6.84385e-11 2.185781e-10 ] [ 2.191382e-10 2.601245e-10 1.67848e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.9577263 -16.1941498 4.4109368 ] [ -10.0632362 3.3190883 -19.2019736 ] [ -11.0632973 12.2119262 14.7206486 ] [ 15.5882872 -11.7872144 3.3249994 ] [ 9.4959726 12.4503497 -3.2546111 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.340976549385288e-09 -2.5945888203293e-08 7.067099816786366e-09 ] [ -1.612308176922823e-08 5.317765676630817e-09 -3.076495317513881e-08 ] [ -1.772535628301977e-08 1.956566265257498e-08 2.358507902993225e-08 ] [ 2.497518931015589e-08 -1.88851993360371e-08 5.327236302854027e-09 ] [ 1.521422529147739e-08 1.99476592101243e-08 -5.214461814216171e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 2.3947585 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.836826081162077e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.1226278 0.0649453 2.3207182 ] [ 0.2108041 1.5130921 0.170996 ] [ 0.1479799 2.3865211 3.476502 ] [ 2.6882069 0.4410119 2.2701085 ] [ 1.9086973 2.8288045 1.6243494 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.226278e-11 6.49453e-12 2.3207182e-10 ] [ 2.108041e-11 1.5130921e-10 1.70996e-11 ] [ 1.479799e-11 2.3865211e-10 3.476502e-10 ] [ 2.6882069e-10 4.410119e-11 2.2701085e-10 ] [ 1.9086973e-10 2.8288045e-10 1.6243494e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.21e-05 3.49e-05 -1.34e-05 ] [ -1.53e-05 7e-07 9.9e-06 ] [ -7.4e-06 6.7e-06 -1.64e-05 ] [ 3.27e-05 -1.68e-05 2.7e-06 ] [ -2.21e-05 -2.54e-05 1.72e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.938633711168e-14 5.591596406592e-14 -2.146916671872e-14 ] [ -2.451330229824e-14 1.12152363456e-15 1.586154854592e-14 ] [ -1.185610699392e-14 1.073458335936e-14 -2.627569658112e-14 ] [ 5.239117550016001e-14 -2.691656722944e-14 4.32587687616e-15 ] [ -3.540810331968e-14 -4.069528616832e-14 2.755743787776e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.8977283 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.425573226049053e-18 } }