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Issue Date | Title | Author(s) |
---|---|---|
2003 | The role of dynamical polarization of the ligand-to-metal charge transfer excitations in the ab initio determination of effective exchange parameters | Gellé, Alain; Munzarová, Markéta L.; Lepetit, Marie-Bernadette; Illas i Riera, Francesc |
2002 | Effective t-J model Hamiltonian parameters of monolayered cuprate superconductors from ab initio electronic structure calculations | Muñoz Ramos, David; Moreira, Ibério de Pinho Ribeiro; Illas i Riera, Francesc |
2003 | Ab initio periodic approach to electronic structure and magnetic exchange in A2CUO2X2 (A=Ca,Sr and X=F,Cl) High-Tc superconductor parent compounds | Moreira, Ibério de Pinho Ribeiro; Dovesi, R. |
2006 | First-principles periodic calculation of four-body spin terms in high-Tc cuprate superconductors | Moreira, Ibério de Pinho Ribeiro; Calzado, C. J.; Malrieu, J. P.; Illas i Riera, Francesc |
2000 | Electronic structure and magnetic interactions of the spin-chain compounds Ca2CuO3 and Sr2CuO3 | Graaf, Coen de; Illas i Riera, Francesc |
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