{ "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" [ [ 1.715482 1.558119 0.3191032 ] [ 2.111919 2.384646 2.793656 ] [ 0.6473775 3.949576 0.9928713 ] [ 3.842985 1.188798 1.171985 ] [ 3.145034 3.056438 0.3971002 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.715482e-10 1.558119e-10 3.191032e-11 ] [ 2.111919e-10 2.384646e-10 2.793656e-10 ] [ 6.473775000000001e-11 3.949576e-10 9.928713000000001e-11 ] [ 3.842985e-10 1.188798e-10 1.171985e-10 ] [ 3.145034e-10 3.056438e-10 3.971002e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.8031313 -6.4663159 -5.187707 ] [ -2.1456775 0.9681866 7.0880389 ] [ -1.2085335 1.0528962 0.5134678 ] [ 7.6403475 -6.9246302 2.8825624 ] [ 5.5169948 11.3698633 -5.2963621 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.570634777949271e-08 -1.036018015768731e-08 -8.311622870960505e-09 ] [ -3.437754326276592e-09 1.551205935091841e-09 1.135629021290095e-08 ] [ -1.936284119153597e-09 1.686925675769161e-09 8.226661046936103e-10 ] [ 1.224118613928773e-08 -1.109448061412563e-08 4.618374085277138e-09 ] [ 8.839200085635171e-09 1.821652916095194e-08 -8.48570753191119e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.2249446 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.769107462295207e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.2885445 1.2004452 0.1273068 ] [ 2.1442544 2.449146 3.0075401 ] [ 1.0676308 3.5198046 1.0253142 ] [ 3.5174905 1.3352277 1.2445756 ] [ 3.4448773 3.6329535 0.269979 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2885445e-10 1.2004452e-10 1.273068e-11 ] [ 2.1442544e-10 2.449146e-10 3.0075401e-10 ] [ 1.0676308e-10 3.5198046e-10 1.0253142e-10 ] [ 3.5174905e-10 1.3352277e-10 1.2445756e-10 ] [ 3.4448773e-10 3.6329535e-10 2.69979e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.5e-06 -1.87e-05 -9e-06 ] [ -5e-06 9.1e-06 1.98e-05 ] [ -5.59e-05 3.97e-05 2e-06 ] [ 4.42e-05 -3.73e-05 -1e-05 ] [ 2.52e-05 7.1e-06 -2.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.36185012768e-14 -2.996070280896e-14 -1.44195895872e-14 ] [ -8.010883104e-15 1.457980724928e-14 3.172309709184e-14 ] [ -8.956167310272e-14 6.360641184576e-14 3.2043532416e-15 ] [ 7.081620663936001e-14 -5.976118795584e-14 -1.6021766208e-14 ] [ 4.037485084416e-14 1.137545400768e-14 -4.48609453824e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.731874 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.719435762017138e-18 } }