{ "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" [ [ 0.7742052 0.6824645 0.5764372 ] [ 0.6127639 2.971614 0.4436307 ] [ 0.405499 2.567939 2.589337 ] [ 2.552542 1.167694 2.901906 ] [ 2.397264 1.657583 0.5767519 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.742052e-11 6.824645e-11 5.764372e-11 ] [ 6.127639e-11 2.971614e-10 4.436307e-11 ] [ 4.05499e-11 2.567939e-10 2.589337e-10 ] [ 2.552542e-10 1.167694e-10 2.901906e-10 ] [ 2.397264e-10 1.657583e-10 5.767519e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -15.6752489 -12.2662213 -0.4828413 ] [ -3.0506131 6.3713578 -4.248102 ] [ -0.7996853 -0.9023078 4.5667425 ] [ 0.2539216 0.5663283 0.7951285 ] [ 19.2716256 6.2308431 -0.6309277 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.511451731280091e-08 -1.965265299241898e-08 -7.73597042416679e-10 ] [ -4.887620987926212e-09 1.020804050991172e-08 -6.806209707173723e-09 ] [ -1.281237091657434e-09 -1.445656461925482e-09 7.316728066713745e-09 ] [ 4.068272510361293e-10 9.073579619574086e-10 1.273936293231773e-09 ] [ 3.087654798113077e-08 9.982911142692997e-09 -1.010857610355116e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.9836352 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.382487183235933e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.5133128 0.4322474 0.2943347 ] [ 0.5864529 2.9665634 0.4944181 ] [ 0.4340099 2.6330707 2.8751148 ] [ 2.4668996 1.3786723 2.9016478 ] [ 2.7415989 1.6367406 0.5225474 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.133128e-11 4.322474e-11 2.943347e-11 ] [ 5.864529000000001e-11 2.9665634e-10 4.944181e-11 ] [ 4.340099e-11 2.6330707e-10 2.8751148e-10 ] [ 2.4668996e-10 1.3786723e-10 2.9016478e-10 ] [ 2.7415989e-10 1.6367406e-10 5.225474e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.42e-05 -4.4e-06 5.6e-06 ] [ 1.08e-05 6.9e-06 6.9e-06 ] [ -1.93e-05 -6.4e-06 -7.6e-06 ] [ 1.28e-05 2.9e-06 8.3e-06 ] [ 1e-05 1e-06 -1.32e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.275090801536e-14 -7.04957713152e-15 8.972189076479999e-15 ] [ 1.730350750464e-14 1.105501868352e-14 1.105501868352e-14 ] [ -3.092200878144e-14 -1.025393037312e-14 -1.217654231808e-14 ] [ 2.050786074624e-14 4.646312200320001e-15 1.329806595264e-14 ] [ 1.6021766208e-14 1.6021766208e-15 -2.114873139456e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.013682 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.764586380932578e-18 } }