Additive Decomposition of the Physical Components of the Magnetic Coupling from Broken Symmetry Density Functional Theory Calculations

Additive Decomposition of the Physical Components of the Magnetic Coupling from Broken Symmetry Density Functional Theory Calculations

Esther Coulaud, Jean-Paul Malrieu, Nathalie Guihery, Nicolas Ferre
Journal of Chemical Theory and Computation, 9 3429-3436 (2013)