{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.147227 2.362862 2.450911 ] [ 2.622761 1.752099 4.557796 ] [ 1.686581 4.667086 2.204349 ] [ 1.229897 3.438837 4.460251 ] [ 4.850673 1.640741 2.950795 ] [ 3.668046 3.670667 2.833872 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.147227e-10 2.362862e-10 2.450911e-10 ] [ 2.622761e-10 1.752099e-10 4.557796e-10 ] [ 1.686581e-10 4.667086e-10 2.204349e-10 ] [ 1.229897e-10 3.438837e-10 4.460251000000001e-10 ] [ 4.850672999999999e-10 1.640741e-10 2.950795e-10 ] [ 3.668046e-10 3.670667e-10 2.833872e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.4638626 -5.5657515 -4.3002443 ] [ 5.6574105 -3.7117705 0.8105883 ] [ -1.6606365 1.2283508 0.4718912 ] [ -3.197375 2.9405294 -0.0670386 ] [ -2.844299 -0.237908 2.384558 ] [ 8.5087627 5.3465498 0.7002454 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.035624962310649e-08 -8.91731700395045e-09 -6.889750937951686e-09 ] [ 9.064170912046255e-09 -5.946911965870496e-09 1.298705634053782e-09 ] [ -2.660632997867541e-09 1.968034950115207e-09 7.560530544302207e-10 ] [ -5.122759515135749e-09 4.711247496270039e-09 -1.074076784960724e-10 ] [ -4.557069397909565e-09 -3.81170638641672e-10 3.820483110017772e-09 ] [ 1.363254078219075e-08 8.566117162077372e-09 1.121916817945983e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.445987 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.154284619246776e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7525112 2.3335462 2.2348313 ] [ 2.6526082 1.3881702 4.290703 ] [ 2.0502713 4.74038 2.7736186 ] [ 1.1688944 3.2722753 4.4596822 ] [ 4.6887411 2.3450241 3.7797049 ] [ 3.8921589 3.4528962 1.9194339 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7525112e-10 2.3335462e-10 2.2348313e-10 ] [ 2.6526082e-10 1.3881702e-10 4.290703e-10 ] [ 2.0502713e-10 4.74038e-10 2.7736186e-10 ] [ 1.1688944e-10 3.2722753e-10 4.4596822e-10 ] [ 4.6887411e-10 2.3450241e-10 3.7797049e-10 ] [ 3.8921589e-10 3.4528962e-10 1.9194339e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8.4e-06 -8.8e-06 -6.2e-06 ] [ -3.9e-06 8.6e-06 -3.6e-06 ] [ -2.85e-05 2.5e-06 1.58e-05 ] [ 2.8e-06 1.37e-05 2.2e-06 ] [ -4.9e-06 9e-07 -1.97e-05 ] [ 2.62e-05 -1.69e-05 1.15e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.34582837256e-14 -1.40991543792e-14 -9.9334951308e-15 ] [ -6.248488872599999e-15 1.37787190524e-14 -5.767835882399999e-15 ] [ -4.5662034069e-14 4.005441585e-15 2.53143908172e-14 ] [ 4.486094575199999e-15 2.19498198858e-14 3.5247885948e-15 ] [ -7.850665506599998e-15 1.4419589706e-15 -3.15628796898e-14 ] [ 4.197702781079999e-14 -2.70767851146e-14 1.8425031291e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.026204 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.888116284851733e-18 } }