{ "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" [ [ 0.635409 0.2945373 0.4894103 ] [ 0.6913641 0.4672635 2.355287 ] [ 2.952385 0.4157679 2.192681 ] [ 2.385934 1.774442 0.4759126 ] [ 2.093707 2.943435 1.550224 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.35409e-11 2.945373e-11 4.894103e-11 ] [ 6.913641e-11 4.672635e-11 2.355287e-10 ] [ 2.952385e-10 4.157679e-11 2.192681e-10 ] [ 2.385934000000001e-10 1.774442e-10 4.759126e-11 ] [ 2.093707e-10 2.943435e-10 1.550224e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -17.826075 -9.7290891 -21.3826466 ] [ -16.8225468 -11.1675702 23.5766056 ] [ 20.921043 -12.9654931 15.4069733 ] [ 16.1684371 -5.5530531 -33.9172817 ] [ -2.4408583 39.4152054 16.3163494 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.856052060562736e-08 -1.558771909770011e-08 -3.425877647334861e-08 ] [ -2.695269118527385e-08 -1.789241988558278e-08 3.777388629014236e-08 ] [ 3.351920597735149e-08 -2.077300992196372e-08 2.468469241854983e-08 ] [ 2.590469191649535e-08 -8.896971850880964e-09 -5.434147578082767e-08 ] [ -3.910686102945633e-09 6.31501205959099e-08 2.614167354548411e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 13.550759 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.171070926389519e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.2628866 0.6366424 0.4362991 ] [ 0.7336605 -0.6297442 2.4655799 ] [ 2.9609849 0.3565074 2.5639999 ] [ 2.4899082 1.6235934 0.5351934 ] [ 2.311359 3.9084467 1.0624425 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.628866e-11 6.366424000000001e-11 4.362991e-11 ] [ 7.336605000000001e-11 -6.297442e-11 2.4655799e-10 ] [ 2.9609849e-10 3.565074e-11 2.5639999e-10 ] [ 2.4899082e-10 1.6235934e-10 5.351934000000001e-11 ] [ 2.311359e-10 3.9084467e-10 1.0624425e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.66e-05 9.5e-06 2.42e-05 ] [ 2.82e-05 1.55e-05 -1.88e-05 ] [ -3.94e-05 3.7e-06 -1.98e-05 ] [ -1.3e-05 -2.21e-05 1.9e-05 ] [ -2.4e-06 -6.6e-06 -4.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.261789811328e-14 1.52206778976e-14 3.877267422336e-14 ] [ 4.518138070656001e-14 2.48337376224e-14 -3.012092047104e-14 ] [ -6.312575885952001e-14 5.928053496960001e-15 -3.172309709184e-14 ] [ -2.08282960704e-14 -3.540810331968e-14 3.04413557952e-14 ] [ -3.84522388992e-15 -1.057436569728e-14 -7.370012455680001e-15 ] ] } "relaxed-potential-energy" { "source-value" -9.7587726 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.563527730742363e-18 } }