{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.4656555 2.854978 2.130075 ] [ 2.415045 0.7163998 1.216409 ] [ 1.531563 1.029003 2.475027 ] [ 2.019704 2.428405 0.6522284 ] [ 2.764103 2.749341 2.416687 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.656555e-11 2.854978e-10 2.130075e-10 ] [ 2.415045e-10 7.163998000000001e-11 1.216409e-10 ] [ 1.531563e-10 1.029003e-10 2.475027e-10 ] [ 2.019704e-10 2.428405e-10 6.522284e-11 ] [ 2.764103e-10 2.749341e-10 2.416687e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -17.7988393 10.8224871 4.0206257 ] [ 11.9270774 -20.3834484 -12.7103668 ] [ -10.3156824 -13.7596815 18.091443 ] [ 0.6805336 10.4764453 -21.6092865 ] [ 15.5069108 12.8441975 12.2075845 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.851688420383624e-08 1.733953581052959e-08 6.441752497527635e-09 ] [ 1.910928456475205e-08 -3.265788447776317e-08 -2.036425252875251e-08 ] [ -1.652754516887804e-08 -2.204544000895427e-08 2.898568701113581e-08 ] [ 1.090335023588859e-09 1.678511572875004e-08 -3.462189362246906e-08 ] [ 2.484480994459102e-08 2.057867294743781e-08 1.955870648234046e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 107.4656 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.721788718602445e-17 } "relaxed-configuration-positions" { "source-value" [ [ -4.1245965 5.9318369 3.0673343 ] [ 5.3433559 -3.789282 -1.2652978 ] [ -0.4338718 -2.5768259 6.8064794 ] [ 2.2843306 5.1401244 -4.5680335 ] [ 6.1268523 5.0722733 4.8499441 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.1245965e-10 5.931836900000001e-10 3.0673343e-10 ] [ 5.3433559e-10 -3.789282e-10 -1.2652978e-10 ] [ -4.338718e-11 -2.5768259e-10 6.8064794e-10 ] [ 2.2843306e-10 5.140124400000001e-10 -4.5680335e-10 ] [ 6.1268523e-10 5.0722733e-10 4.8499441e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 0.0 0.0 ] [ 0.0 -0.0 -0.0 ] [ -0.0 -0.0 0.0 ] [ 0.0 0.0 -0.0 ] [ 0.0 0.0 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 0.0 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 0.0 } }