{ "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" [ [ 2.007741 0.810981 1.851579 ] [ 2.28758 2.972606 1.775704 ] [ 2.775609 2.277586 3.884458 ] [ 3.461309 1.568578 0.4572952 ] [ 4.556331 2.173826 2.191246 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.007741e-10 8.10981e-11 1.851579e-10 ] [ 2.28758e-10 2.972606e-10 1.775704e-10 ] [ 2.775609000000001e-10 2.277586e-10 3.884458e-10 ] [ 3.461309e-10 1.568578e-10 4.572952e-11 ] [ 4.556331e-10 2.173826e-10 2.191246e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1916836 -1.787892 3.9405881 ] [ 0.5949479 2.69459 -0.0655329 ] [ 0.6191283 -1.4061926 -1.5441498 ] [ 0.9820224 -0.567932 -6.070792 ] [ -1.004415 1.0674266 3.7398865 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.909287603310779e-09 -2.864518762915354e-09 6.313518126022692e-09 ] [ 9.532116159740564e-10 4.317209100641471e-09 -1.049952802732243e-10 ] [ 9.919528875356486e-10 -2.252968908061966e-09 -2.474000708572996e-09 ] [ 1.573373330381906e-09 -9.099273726041856e-10 -9.726481012139673e-09 ] [ -1.609250230580832e-09 1.710205942940033e-09 5.991958714745538e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.134674 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.065712732942962e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9567045 0.8458477 2.0089456 ] [ 2.3901589 3.0778104 1.7175235 ] [ 2.7815914 2.0607648 3.8060226 ] [ 3.4687306 1.4781389 0.3657959 ] [ 4.4913846 2.3410153 2.2619947 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9567045e-10 8.458477000000001e-11 2.0089456e-10 ] [ 2.3901589e-10 3.0778104e-10 1.7175235e-10 ] [ 2.7815914e-10 2.0607648e-10 3.8060226e-10 ] [ 3.4687306e-10 1.4781389e-10 3.657959e-11 ] [ 4.4913846e-10 2.3410153e-10 2.2619947e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.7e-06 2.27e-05 -2.36e-05 ] [ 2.17e-05 -4.62e-05 6e-06 ] [ 1.71e-05 4.6e-06 -2.64e-05 ] [ -2.6e-05 2.1e-06 2.83e-05 ] [ -1.55e-05 1.68e-05 1.56e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.32587687616e-15 3.636940929216e-14 -3.781136825088e-14 ] [ 3.476723267136e-14 -7.402055988096e-14 9.6130597248e-15 ] [ 2.739722021568e-14 7.370012455680001e-15 -4.229746278912e-14 ] [ -4.16565921408e-14 3.36457090368e-15 4.534159836864e-14 ] [ -2.48337376224e-14 2.691656722944e-14 2.499395528448e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.467452 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.279247308174621e-18 } }