{ "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" [ [ 1.498941 0.2917441 1.412179 ] [ 0.7321813 1.344758 2.47059 ] [ 0.7391833 1.573141 0.3619984 ] [ 0.011627 2.973124 1.6693 ] [ 2.701347 1.320916 0.403113 ] [ 2.713757 1.097636 2.168947 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.498941e-10 2.917441e-11 1.412179e-10 ] [ 7.321813e-11 1.344758e-10 2.47059e-10 ] [ 7.391833000000001e-11 1.573141e-10 3.619984e-11 ] [ 1.1627e-12 2.973124e-10 1.6693e-10 ] [ 2.701347e-10 1.320916e-10 4.03113e-11 ] [ 2.713757e-10 1.097636e-10 2.168947e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -16.4708119 -68.0731265 -17.3989446 ] [ -37.5691463 12.7584524 53.0818846 ] [ -22.889131 14.1897303 -31.034638 ] [ -8.0213415 15.6779647 0.4407062 ] [ 39.5456058 11.3190335 -50.6351563 ] [ 45.4048248 14.1279455 45.5461481 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.638914996918914e-08 -1.090651726816262e-07 -2.787618249438047e-08 ] [ -6.019240836118755e-08 2.044129432128122e-08 8.504655519480444e-08 ] [ -3.667243086076505e-08 2.273445432942181e-08 -4.972297184824849e-08 ] [ -1.285160592463451e-08 2.511886871101682e-08 7.060891760989307e-10 ] [ 6.335904559013487e-08 1.813509099316324e-08 -8.112646428279788e-08 ] [ 7.274654936542371e-08 2.263546416652544e-08 7.297297425452349e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 37.666766 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.034881236354564e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2214987 -0.1148703 1.2726887 ] [ 0.728446 1.5053719 3.1969507 ] [ 0.5958072 1.8374597 -0.2661361 ] [ -0.3306297 2.9356333 1.6246626 ] [ 3.0428342 1.3393444 0.0725342 ] [ 3.1390801 1.09838 2.5854273 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2214987e-10 -1.148703e-11 1.2726887e-10 ] [ 7.284460000000001e-11 1.5053719e-10 3.1969507e-10 ] [ 5.958072e-11 1.8374597e-10 -2.661361e-11 ] [ -3.306297e-11 2.9356333e-10 1.6246626e-10 ] [ 3.0428342e-10 1.3393444e-10 7.253419999999999e-12 ] [ 3.1390801e-10 1.09838e-10 2.5854273e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.29e-05 1.6e-06 7.1e-06 ] [ 9.7e-06 -8.4e-06 3.4e-06 ] [ -7.1e-06 7.2e-06 3.2e-06 ] [ 1.5e-06 -5.9e-06 -1.65e-05 ] [ 5.6e-06 5.3e-06 -1.9e-06 ] [ 3.2e-06 0.0 4.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.06680785786e-14 2.5634826144e-15 1.13754541014e-14 ] [ 1.55411133498e-14 -1.34582837256e-14 5.4474005556e-15 ] [ -1.13754541014e-14 1.15356717648e-14 5.1269652288e-15 ] [ 2.403264951e-15 -9.452842140600001e-15 -2.6435914461e-14 ] [ 8.972189150399999e-15 8.4915361602e-15 -3.0441356046e-15 ] [ 5.1269652288e-15 0.0 7.370012516399999e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.047461 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.250651378122627e-18 } }