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Issue Date
Title
Author(s)
2006
Importance of the embedding environment on the strain within small rings in siliceous materials
Bromley, Stefan Thomas; Moreira, Ibério de Pinho Ribeiro; Illas i Riera, Francesc; Wojdel, Jacek C.
2005
Magnitude of interplane effective parameters in multilayered high-Tc cuprate superconductors
Muñoz Ramos, David; Moreira, Ibério de Pinho Ribeiro; 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
2002
Magnetic structure of Li2CuO2: From ab initio calculations to macroscopic simulations
Graaf, Coen de; Moreira, Ibério de Pinho Ribeiro; Illas i Riera, Francesc; Iglesias, Òscar; Labarta, Amílcar
2002
Derivation of spin Hamiltonians from the exact Hamiltonian: Application to systems with two unpaired electrons per magnetic site
Moreira, Ibério de Pinho Ribeiro; Suaud, N.; Guihery, N.; Malrieu, J. P.; Caballol Lorenzo, Rosa; Bofill i Villà, Josep M.; Illas i Riera, Francesc
2000
Accurate prediction of large antiferromagnetic interactions in High-Tc HgBa2Can-1CunO2n+2+delta (n = 2,3) superconductor parent compounds
Muñoz Ramos, David; Illas i Riera, Francesc; Moreira, Ibério de Pinho Ribeiro
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
2002
Effect of Fock exchange on the electronic structure and magnetic coupling in NiO
Moreira, Ibério de Pinho Ribeiro; Illas i Riera, Francesc; Martin, Richard L.
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.
2000
Ab initio study of MF2 (M=Mn, Fe, Co, Ni) rutile-type compounds using the periodic unrestricted Hartree-Fock approach
Moreira, Ibério de Pinho Ribeiro; Dovesi, R.; Roetti, C.; Saunders, Víctor R.; Orlando, Roberto
Discover
Author
10
Illas i Riera, Francesc
3
Muñoz Ramos, David
2
Bofill i Villà, Josep M.
2
Dovesi, R.
2
Graaf, Coen de
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Subject
7
Estructura electrònica
7
Propietats magnètiques
6
Electronic structure
5
Magnetic properties
5
Superconductivity
.
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Date issued
2
2006
1
2005
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2002
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