{ "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" [ [ 0.7872548 2.971705 2.821442 ] [ 1.838331 0.4014098 1.675971 ] [ 2.974058 1.714847 0.8061894 ] [ 1.598524 2.494897 0.1079685 ] [ 2.930835 1.52262 2.533969 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.872548000000001e-11 2.971705e-10 2.821442e-10 ] [ 1.838331e-10 4.014098e-11 1.675971e-10 ] [ 2.974058e-10 1.714847e-10 8.061894e-11 ] [ 1.598524e-10 2.494897e-10 1.079685e-11 ] [ 2.930835e-10 1.52262e-10 2.533969e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.0550066 3.6543213 3.6047671 ] [ -5.076472 -9.688602 0.1129722 ] [ 8.3831709 0.4098028 -6.2498725 ] [ -5.1795675 4.7871542 -7.0493508 ] [ 5.9278751 0.8373237 9.581484 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.496836771709696e-09 5.854868151751463e-09 5.775473571049016e-09 ] [ -8.133404754545817e-09 -1.552285161263612e-08 1.810014176403418e-10 ] [ 1.343132042415089e-08 6.565764652983783e-10 -1.001339960248085e-08 ] [ -8.298581954355503e-09 7.669866539404528e-09 -1.129430504357778e-08 ] [ 9.497502896242461e-09 1.341540456181753e-09 1.535122965736927e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 37.567807 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.019026207012659e-18 } "relaxed-configuration-positions" { "source-value" [ [ -1.299167 4.6034788 4.620705 ] [ 0.3885755 -2.3598003 1.5813494 ] [ 6.3201725 1.48643 -1.4327769 ] [ -0.491863 3.9605414 -2.6564779 ] [ 5.2112848 1.4148289 5.8327403 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.299167e-10 4.6034788e-10 4.620705e-10 ] [ 3.885755e-11 -2.3598003e-10 1.5813494e-10 ] [ 6.3201725e-10 1.48643e-10 -1.4327769e-10 ] [ -4.91863e-11 3.9605414e-10 -2.6564779e-10 ] [ 5.2112848e-10 1.4148289e-10 5.832740300000001e-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 } }