{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.888839 2.682802 2.483288 ] [ 4.584027 1.697115 1.780244 ] [ 5.622084 2.160801 4.094107 ] [ 3.250182 0.9950144 3.979579 ] [ 5.691266 3.575432 2.207922 ] [ 3.710937 3.502612 1.042458 ] [ 3.524601 3.924526 3.14177 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.888839e-10 2.682802e-10 2.483288e-10 ] [ 4.584027e-10 1.697115e-10 1.780244e-10 ] [ 5.622084000000001e-10 2.160801e-10 4.094107000000001e-10 ] [ 3.250182e-10 9.950144e-11 3.979579e-10 ] [ 5.691266e-10 3.575432e-10 2.207922e-10 ] [ 3.710937e-10 3.502612e-10 1.042458e-10 ] [ 3.524601e-10 3.924526e-10 3.14177e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.1515241 -5.9098614 0.5988224 ] [ 1.3355999 -15.7413878 -4.8762863 ] [ 2.8628173 -0.3036511 4.9839577 ] [ -1.0563264 -0.9900622 -0.3047472 ] [ 13.6236858 5.4872945 2.4709893 ] [ -6.1809226 5.4386747 -14.9453849 ] [ -0.43333 12.0189933 12.072649 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.626453471250788e-08 -9.468641845258526e-09 9.594192571958015e-10 ] [ 2.139866952152737e-09 -2.522048371989266e-08 -7.812671970554314e-09 ] [ 4.586738985470968e-09 -4.865026973083974e-10 7.985180571784381e-09 ] [ -1.692421475957338e-09 -1.586254523046635e-09 -4.882588431169247e-10 ] [ 2.18275510577176e-08 8.791615031776712e-09 3.958961319324015e-09 ] [ -9.902929766282527e-09 8.71371752426696e-09 -2.394514647291642e-08 ] [ -6.942712008112199e-10 1.925655022946255e-08 1.934251613828346e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -6.6875927 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.071470476164897e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1735214 2.8985667 2.8305184 ] [ 4.8156572 1.7562448 1.2795033 ] [ 5.4582363 1.8787459 4.8088544 ] [ 3.6418074 0.9741224 3.2983535 ] [ 5.7517807 3.4279226 2.831082 ] [ 2.7090252 2.8126354 0.3599814 ] [ 3.7219078 4.7900647 3.321075 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1735214e-10 2.8985667e-10 2.8305184e-10 ] [ 4.815657200000001e-10 1.7562448e-10 1.2795033e-10 ] [ 5.4582363e-10 1.8787459e-10 4.8088544e-10 ] [ 3.6418074e-10 9.741224e-11 3.2983535e-10 ] [ 5.751780700000001e-10 3.4279226e-10 2.831082e-10 ] [ 2.7090252e-10 2.8126354e-10 3.599814e-11 ] [ 3.7219078e-10 4.790064700000001e-10 3.321075e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.9e-06 9.2e-06 -2.9e-06 ] [ 1.19e-05 -1.9e-06 -9.7e-06 ] [ 1.5e-05 -9e-06 4.3e-06 ] [ 5.6e-06 2.7e-06 2.4e-06 ] [ -1.72e-05 -1.65e-05 7.1e-06 ] [ -2e-07 4e-07 5.5e-06 ] [ -9.2e-06 1.51e-05 -6.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.452842140600001e-15 1.47400250328e-14 -4.6463122386e-15 ] [ 1.90659019446e-14 -3.0441356046e-15 -1.55411133498e-14 ] [ 2.403264951e-14 -1.4419589706e-14 6.8893595262e-15 ] [ 8.972189150399999e-15 4.3258769118e-15 3.845223921599999e-15 ] [ -2.75574381048e-14 -2.6435914461e-14 1.13754541014e-14 ] [ -3.204353268e-16 6.408706536e-16 8.811971486999999e-15 ] [ -1.47400250328e-14 2.41928671734e-14 -1.07345834478e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.813779 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.334735037903988e-18 } }