{ "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" [ [ 0.8760834 0.5811476 0.1887226 ] [ 0.0667642 0.1957144 2.535937 ] [ 2.950388 1.045755 1.267551 ] [ 1.713434 2.554048 0.6359242 ] [ 2.757437 2.623078 2.535254 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.760833999999999e-11 5.811476e-11 1.887226e-11 ] [ 6.67642e-12 1.957144e-11 2.535937e-10 ] [ 2.950388e-10 1.045755e-10 1.267551e-10 ] [ 1.713434e-10 2.554048e-10 6.359242000000001e-11 ] [ 2.757437e-10 2.623078e-10 2.535254e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.0799777 -3.9114851 -1.0219792 ] [ -1.3074664 -0.1965781 0.0506043 ] [ 9.4618873 -12.624872 -2.3883524 ] [ -6.622517 10.0156188 -6.2108468 ] [ 1.5480738 6.7173165 9.5705741 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.934668263525356e-09 -6.26688997982755e-09 -1.637391181183888e-09 ] [ -2.094792098561541e-09 -3.149528359812845e-10 8.107702637194943e-11 ] [ 1.515961462070444e-08 -2.022727475899254e-08 -3.82656237751157e-09 ] [ -1.061044190825055e-08 1.604679028420495e-08 -9.950873538330494e-09 ] [ 2.480287649633016e-09 1.076232745081408e-08 1.5333750070654e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -4.9061568 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.860529722938942e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.0465843 0.7389712 1.010242 ] [ -0.715298 -0.4976603 1.8158869 ] [ 3.3371316 0.6104982 1.7294648 ] [ 1.2028207 3.1371083 0.9401087 ] [ 3.4928681 3.0108256 1.6676865 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0465843e-10 7.389712e-11 1.010242e-10 ] [ -7.15298e-11 -4.976603e-11 1.8158869e-10 ] [ 3.3371316e-10 6.104982e-11 1.7294648e-10 ] [ 1.2028207e-10 3.1371083e-10 9.401087e-11 ] [ 3.4928681e-10 3.0108256e-10 1.6676865e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2e-07 -2.44e-05 1.77e-05 ] [ 9.1e-06 1.67e-05 -1.99e-05 ] [ 8.5e-06 -9.1e-06 1.16e-05 ] [ -3.94e-05 2.14e-05 3.7e-06 ] [ 2.15e-05 -4.5e-06 -1.3e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.2043532416e-16 -3.909310954752e-14 2.835852618816e-14 ] [ 1.457980724928e-14 2.675634956736e-14 -3.188331475392e-14 ] [ 1.36185012768e-14 -1.457980724928e-14 1.858524880128e-14 ] [ -6.312575885952001e-14 3.428657968511999e-14 5.928053496960001e-15 ] [ 3.44467973472e-14 -7.2097947936e-15 -2.08282960704e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.412845 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.828539343581418e-18 } }