| 1 |
Electronic Structure and Magnetic Properties of CuFeS2
Conejeros S, Alemany P, Llunell M, Moreira IDR, Sanchez V, Llanos J
Inorganic Chemistry, 54(10), 4840, 2015 |
| 2 |
Structural Stability of Quaternary ACuFeS(2) (A = Li, K) Phases: A Computational Approach
Conejeros S, Alemany P, Llunell M, Sanchez V, Llanos J, Padilla-Campos L
Inorganic Chemistry, 51(1), 362, 2012 |
| 3 |
Host-Guest Interactions, Uniform vs Fragmented Linear Atom Chains and Likeliness of Peierls Distortions in the (Ca7N4)[M-x] (M = Ag, Ga, In) Phases
Alemany P, Llunell M, Canadell E
Inorganic Chemistry, 48(7), 2919, 2009 |
| 4 |
Electronic Structure and Spin Exchange Interactions in Na2V3O7: a Vanadium(IV) Oxide Nanotubular Phase
Rodriguez-Fortea A, Llunell M, Alemany P, Canadell E
Inorganic Chemistry, 48(13), 5779, 2009 |
| 5 |
Concerning the different roles of cations in metallic Zintl phases: Ba7Ga4Sb9 as a test case
Alemany P, Llunell M, Canadell E
Inorganic Chemistry, 45(18), 7235, 2006 |
| 6 |
Theoretical determination of multiple exchange couplings and magnetic susceptibility data in inorganic solids: The prototypical case of Cu-2(OH)(3)NO3
Ruiz E, Llunell M, Cano J, Rabu P, Drillon M, Massobrio C
Journal of Physical Chemistry B, 110(1), 115, 2006 |
| 7 |
Electronic structure of Li2Ga and Li9Al4, two solids containing infinite and uniform zigzag chains
Alemany P, Llunell M, Canadell E
Inorganic Chemistry, 44(2), 374, 2005 |
| 8 |
Electronic structure of the K3Bi2 metallic phase
Alemany P, Llunell M, Canadell E
Inorganic Chemistry, 44(6), 1644, 2005 |
| 9 |
Magnetic properties of cyano-bridged Ln(3+)-M3+ complexes. Part I: Trinuclear complexes (Ln(3+) = La, Ce, Pr, Nd, Sm; M3+ = Fe-LS, Co) with bpy as blocking ligand
Figuerola A, Ribas J, Llunell M, Casanova D, Maestro M, Alvarez S, Diaz C
Inorganic Chemistry, 44(20), 6939, 2005 |
| 10 |
Minimal distortion pathways in polyhedral rearrangements
Casanova D, Cirera J, Llunell M, Alemany P, Avnir D, Alvarez S
Journal of the American Chemical Society, 126(6), 1755, 2004 |
