{ "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" [ [ 2.975716 3.919 3.294603 ] [ 5.229011 2.380728 1.260294 ] [ 3.72512 0.5184044 0.8589665 ] [ 3.15133 1.64182 3.064405 ] [ 5.039876 3.004083 3.766304 ] [ 5.090657 4.730463 1.850516 ] [ 3.207695 3.468122 0.7711985 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.975716e-10 3.919e-10 3.294603e-10 ] [ 5.229011e-10 2.380728e-10 1.260294e-10 ] [ 3.72512e-10 5.184044e-11 8.589665e-11 ] [ 3.151330000000001e-10 1.64182e-10 3.064405e-10 ] [ 5.039876e-10 3.004083e-10 3.766304e-10 ] [ 5.090657000000001e-10 4.730463000000001e-10 1.850516e-10 ] [ 3.207695e-10 3.468122e-10 7.711985e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.133134 3.9006669 -0.5156751 ] [ 4.6606171 -1.6413721 -2.5003485 ] [ -0.2335202 -0.242606 0.5483009 ] [ -3.240361 -5.7764299 2.6433573 ] [ 3.8364114 -0.7430628 1.4832385 ] [ 0.4275943 2.2674942 0.507749 ] [ -2.3176076 2.2353097 -2.1666221 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.019834044633588e-09 6.249557312708412e-09 -8.262025891487022e-10 ] [ 7.467131756120696e-09 -2.6297680046534e-09 -4.005999910552348e-09 ] [ -3.741406049245402e-10 -3.886976612658048e-10 8.784748831435987e-10 ] [ -5.191630637152108e-09 -9.254860937470082e-09 4.235125266481012e-09 ] [ 6.146608652850597e-09 -1.190517845946186e-09 2.37641004777046e-09 ] [ 6.850815906473414e-10 3.632926195039599e-09 8.135035770345793e-10 ] [ -3.713216712908398e-09 3.581360941587462e-09 -3.4713112747286e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.415406 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.309602647254005e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7995797 3.8080682 2.954058 ] [ 5.1487471 2.4090073 0.9478149 ] [ 3.8633963 0.4377037 1.4017732 ] [ 3.0430905 1.3410327 3.4393644 ] [ 5.1640216 2.7295196 3.5656033 ] [ 5.1222365 4.8510846 2.0994032 ] [ 3.2783333 4.0862042 0.4582701 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7995797e-10 3.8080682e-10 2.954058e-10 ] [ 5.1487471e-10 2.4090073e-10 9.478149e-11 ] [ 3.8633963e-10 4.377037e-11 1.4017732e-10 ] [ 3.0430905e-10 1.3410327e-10 3.4393644e-10 ] [ 5.1640216e-10 2.7295196e-10 3.5656033e-10 ] [ 5.122236499999999e-10 4.851084600000001e-10 2.0994032e-10 ] [ 3.2783333e-10 4.0862042e-10 4.582701e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.69e-05 0.0001343 -0.0001065 ] [ -0.0001851 -0.0006591 -0.0004875 ] [ -0.0001026 0.0002585 0.0005 ] [ 5.59e-05 -0.0005212 -0.000292 ] [ 0.0001767 4.1e-05 0.0001272 ] [ -7.1e-06 0.0006737 0.0003711 ] [ 9.91e-05 7.28e-05 -0.0001124 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.912031730752001e-14 2.1517232017344e-13 -1.706318101152e-13 ] [ -2.9656289251008e-13 -1.05599461076928e-12 -7.810611026400001e-13 ] [ -1.6438332129408e-13 4.141626564768e-13 8.010883104000001e-13 ] [ 8.956167310272e-14 -8.3505445476096e-13 -4.678355732736e-13 ] [ 2.8310460889536e-13 6.56892414528e-14 2.0379686616576e-13 ] [ -1.137545400768e-14 1.07938638943296e-12 5.945677439788801e-13 ] [ 1.5877570312128e-13 1.1663845799424e-13 -1.8008465217792e-13 ] ] } "relaxed-potential-energy" { "source-value" -16.785012 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.689255380624745e-18 } }