{ "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" [ [ 2.690681 1.842727 3.696963 ] [ 2.658202 3.646198 2.018485 ] [ 5.329976 0.2810446 1.792372 ] [ 5.111587 2.700534 2.069297 ] [ 3.393505 1.493232 0.8693091 ] [ 5.014849 1.504764 3.993476 ] [ 3.843884 3.656776 4.040771 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.690681e-10 1.842727e-10 3.696963e-10 ] [ 2.658202e-10 3.646198e-10 2.018485e-10 ] [ 5.329976000000001e-10 2.810446e-11 1.792372e-10 ] [ 5.111587e-10 2.700534e-10 2.069297e-10 ] [ 3.393505e-10 1.493232e-10 8.693091e-11 ] [ 5.014849e-10 1.504764e-10 3.993476e-10 ] [ 3.843884e-10 3.656776e-10 4.040771000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -24.1946119 -16.3639583 15.6791348 ] [ -13.5791504 12.4757247 -10.5057453 ] [ 4.3622269 -11.7484764 -3.2098129 ] [ 29.3000803 13.3662485 -17.4281938 ] [ -6.3322842 -5.8368548 -12.5811176 ] [ 10.6958039 -12.1436438 12.4734091 ] [ -0.2520647 20.25096 15.5723258 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.876404153550947e-08 -2.621795141200611e-08 2.512074321093168e-08 ] [ -2.175619730120697e-08 1.99883144418771e-08 -1.683205950373948e-08 ] [ 6.989057953804859e-09 -1.882313421810055e-08 -5.142687185522249e-09 ] [ 4.694390364422265e-08 2.141509085450307e-08 -2.792304464913151e-08 ] [ -1.014543770150123e-08 -9.351672299564261e-09 -2.015717248225541e-08 ] [ 1.713656694924146e-08 -1.945626218768287e-08 1.998460444169397e-08 ] [ -4.038521692689657e-10 3.244561466075596e-08 2.494961632824065e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 11.185688 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.792144780116311e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.1199762 1.7163457 4.5372794 ] [ 2.6637811 3.596733 1.3006599 ] [ 4.7898385 0.2237575 1.5035363 ] [ 5.862982 3.3698943 3.2839119 ] [ 2.8279353 1.3017922 0.7058797 ] [ 5.298337 1.015828 3.6614685 ] [ 3.479834 3.9009249 3.4879374 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.1199762e-10 1.7163457e-10 4.5372794e-10 ] [ 2.6637811e-10 3.596733e-10 1.3006599e-10 ] [ 4.7898385e-10 2.237575e-11 1.5035363e-10 ] [ 5.862982e-10 3.3698943e-10 3.2839119e-10 ] [ 2.8279353e-10 1.3017922e-10 7.058797e-11 ] [ 5.298337000000001e-10 1.015828e-10 3.6614685e-10 ] [ 3.479834e-10 3.9009249e-10 3.4879374e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.61e-05 -6.52e-05 2.5e-06 ] [ 4.42e-05 4.76e-05 3.7e-06 ] [ -4.18e-05 3.2e-05 -5.25e-05 ] [ 6.65e-05 6.26e-05 3.8e-06 ] [ -3.24e-05 -6.33e-05 3.47e-05 ] [ 6.03e-05 -5.56e-05 6.12e-05 ] [ -5.07e-05 4.19e-05 -5.34e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.386034221888001e-14 -1.0446191567616e-13 4.005441552e-15 ] [ 7.081620663936001e-14 7.626360715008e-14 5.928053496960001e-15 ] [ -6.697098274944e-14 5.12696518656e-14 -8.4114272592e-14 ] [ 1.065447452832e-13 1.0029625646208e-13 6.08827115904e-15 ] [ -5.191052251392001e-14 -1.0141778009664e-13 5.559552874176001e-14 ] [ 9.661125023424001e-14 -8.908102011648e-14 9.805320919295999e-14 ] [ -8.123035467456e-14 6.713120041152e-14 -8.555623155072e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.090724 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.738235842534546e-18 } }