{ "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" [ [ 2.8328 1.144076 3.909989 ] [ 1.831555 2.949109 3.983595 ] [ 4.980623 2.123246 2.998848 ] [ 3.28235 2.585733 1.880535 ] [ 4.448764 2.855471 5.04642 ] [ 4.331941 4.016039 3.033368 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8328e-10 1.144076e-10 3.909989e-10 ] [ 1.831555e-10 2.949109e-10 3.983595000000001e-10 ] [ 4.980622999999999e-10 2.123246e-10 2.998848e-10 ] [ 3.28235e-10 2.585733e-10 1.880535e-10 ] [ 4.448764e-10 2.855471e-10 5.04642e-10 ] [ 4.331941e-10 4.016039e-10 3.033368e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.676375 -19.853722 5.7682189 ] [ -10.7789345 9.2681472 5.1294819 ] [ 25.2211888 -17.2395238 -3.7535176 ] [ -12.121022 -1.4873827 -23.0561762 ] [ 2.4970958 3.4851341 14.9193214 ] [ 1.8580467 25.8273472 0.9926715 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.06967319366936e-08 -3.180916922426262e-08 9.241705465236692e-09 ] [ -1.726975685303454e-08 1.484920876197298e-08 8.218335976996763e-09 ] [ 4.04087990441428e-08 -2.762076198608518e-08 -6.013798144481326e-09 ] [ -1.942001806860246e-08 -2.38304978812238e-09 -3.694006647268539e-08 ] [ 4.000788510657872e-09 5.583800375372849e-09 2.390338794528113e-08 ] [ 2.976918983094592e-09 4.137997186112434e-08 1.590435069434467e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 27.362697 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.38398734154343e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9021784 0.5756561 4.2831876 ] [ 0.6661649 1.9404077 4.5875097 ] [ 4.6384337 1.8367154 3.189449 ] [ 4.1992899 3.1277382 1.3420127 ] [ 5.3719102 3.4509113 4.6485492 ] [ 4.9300559 4.7422453 2.8020468 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9021784e-10 5.756561e-11 4.2831876e-10 ] [ 6.661649e-11 1.9404077e-10 4.5875097e-10 ] [ 4.6384337e-10 1.8367154e-10 3.189449e-10 ] [ 4.1992899e-10 3.1277382e-10 1.3420127e-10 ] [ 5.371910200000001e-10 3.4509113e-10 4.6485492e-10 ] [ 4.9300559e-10 4.742245300000001e-10 2.8020468e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.72e-05 -1.43e-05 -2.01e-05 ] [ -3.18e-05 -3.48e-05 1.47e-05 ] [ -3.7e-06 -7.17e-05 2.81e-05 ] [ -1.6e-06 -3.8e-06 1.44e-05 ] [ 5.56e-05 2.73e-05 -5.7e-06 ] [ 2.87e-05 9.73e-05 -3.15e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.562273650176e-14 -2.291112567744e-14 -3.220375007808e-14 ] [ -5.094921654144e-14 -5.575574640383999e-14 2.355199632576e-14 ] [ -5.928053496960001e-15 -1.1487606371136e-13 4.502116304448e-14 ] [ -2.56348259328e-15 -6.08827115904e-15 2.307134333952e-14 ] [ 8.908102011648e-14 4.373942174784e-14 -9.13240673856e-15 ] [ 4.598246901696e-14 1.5589178520384e-13 -5.04685635552e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.657781 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.630176699740644e-18 } }