| P. Alemany, J.-P. Pouget and E. Canadell. «Structural and electronic control of the metal to insulator transition and local orderings in the θ-(BEDT-TTF)2X organic conductors». J. Phys. Condens. Matter, 2015, 27, 465702 (17 pp). |
| D. H. Galván, R. Núñez-González, R. Rangel, P. Alemany and A. Posada-Amarillas. «Assessment of Functionals for First-Principle Studies of the Structural and Electronic Properties of δ-Bi2O3«. Adv. Cond. Matter Phys. 2015, 120294. |
| P. Alemany and E. Canadell. «Links between the crystal and electronic structure in the new family of unconventional superconductors A2Cr3As3 (A = K, Rb, Cs)». Inorg. Chem., 2015, 54, 8029-8034. |
| K. Medjanik, A. Chernenkaya, S. A. Nepijko, G. Öhrwall, P. Foury-Leylekian, P. Alemany, E. Canadell, G. Schönhense and J.-P. Pouget. «Donor-anion interactions at the charge localization and charge ordering transitions of (TMTTF)2AsF6probed by NEXAFS». Phys. Chem. Chem. Phys., 2015, 17, 19202-19214. |
| S. Conejeros, P. Alemany, M. Llunell, I. de P. R. Moreira, V. Sánchez and J. Llanos. «Electronic structure and magnetic properties of CuFeS2«. Inorg. Chem., 2015, 54, 4840-4849. |
| W. Kaddour, P. Auban-Senzier, H. Raffy, M. Monteverde, J.-P. Pouget, C. R. Pasquier, P. Alemany, E. Canadell and L. Valade. «Metal-charge density wave coexistence in TTF[Ni(dmit)2]2«. Physica B, 2015, 460, 147-150. |
| P. Alemany, E. Canadell, Y. Geng, J. Hauser, P. Macchi, K. Krämer, S. Decurtins and S.-X. Liu. «Exploring the Electronic Structure of an Organic Semiconductor Based on a Compactly Fused Electron Donor-Acceptor Molecule». ChemPhysChem, 2015, 16, 1361-1365. |
| L. Escriche-Tur, J. Jover, M. Font-Bardia, G. Aullón and M. Corbella, «Magnetic Behavior of Heterometallic Wheels Having a [MnIV6M2O9]10+Core with M = Ca2+and Sr2+«. Inorg. Chem., 2015, 54, 11596-11605. Doi: 10.1021/acs.inorgchem.5b02131. |
| S. Gómez-Coca and E. Ruiz. «Magnetic Behaviour of Transition Metal Complexes with Functionalized Chiral and C60-Filled Nanotubes as Bridging Ligands: A Theoretical Study». Magnetochem., 2015, 1, 62-71. |
| S. Alvarez, «Distortion Pathways of Transition Metal Coordination Polyhedra Induced by Chelating Topology». Chem. Rev., 2015, 115, 13447-13483. Doi: 10.1021/acs.chemrev.5b00537. Open access. |
| A. Falceto, K. H. Theopold and S. Alvarez, «Cr-Cr Quintuple Bonding: Ligand Topology and Interplay Between Metal-Metal and Metal-Ligand Bonding». Inorg. Chem., 2015, 54, 10966-10977. Doi: 10.1021/acs.inorgchem.5b02059, open access. |
| S. Alvarez, «What do we mean when we talk about bonds». Chem. World, 2015, 12, 36-37. |
| W. Mahy, P. Plucinski, J. Jover and C. G. Frost, «Ruthenium-catalyzed O- to S-alkyl migration: A pseudoreversible Barton-McCombie pathway». Angew. Chem. Int. Ed., 2015, 54, 10944-10948. Doi: 10.1002/anie.201505280. |
| L.-F. Wang, J.-Z. Qiu, J.-L. Liu, Y.-C. Chen, J.-H. Jia, J. Jover, E. Ruiz and M.-L. Tong, «Modulation of single-molecule magnet behaviour via photochemical 2+2 cycloaddition». Chem. Commun., 2015, 51, 15358-15361. |
| I. Oyarzábal, J. Ruiz, E. Ruiz, D. Aravena, J. M. Seco and E. Colacio, «Increasing the effective energy barrier promoted by the change of a counteranion in a Zn-Dy-Zn SMM: slow relaxation via the second excited state». Chem. Commun., 2015, 51, 12353-12356. |
| L. Maxwell, S. Gómez-Coca, T. Weyhermueller, D. Panyella and E. Ruiz, «A trinuclear CuII complex with functionalized s-heptazine N-ligands: molecular chemistry from a g-C3N4 fragment». Dalton Trans., 2015, 44, 15761-15763. |
| F. A. Mautner, C. Berger, M. Scherzer, R. C. Fischer, L. Maxwell, E. Ruiz and R. Vicente, «Different topologies in three manganese-μ-azido 1D compounds: magnetic behavior and DFT-quantum Monte Carlo calculations». Dalton Trans., 2015, 44, 18632-18642. |
| A. K. Jassal, N. Aliaga-Alcalde, M. Corbella, D. Aravena, E. Ruiz and G. Hundal, «Neodymium 1D systems: targeting new sources for field-induced slow magnetization relaxation». Dalton Trans., 2015, 44, 15774-15778. |
| J. Cirera and E. Ruiz, «Theoretical modeling of two-step spin-crossover transitions in FeII dinuclear systems». J. Mater. Chem. C, 2015, 3, 7954-7961. |
| J. Adhikary, P. Kundu, S. Dasgupta, S. Mukherjee, S. Chattopadhyay, G. Aullón, D. Das, «Nickel(II) Complexes having Different Configurations controlled by N,N,O-donor Schiff-base Ligands in Presence of Isothiocyanate as Co-ligand: Synthesis, Structures, Comparative Biological Activity and DFT Study». Polyhedron 2015, 101, 93-102, Doi: 10.1016/j.poly.2015.07.055 |
| J. E. Expósito, M. Alvarez-Paino, G. Aullón, J. A. Miguel and P. Espinet, «Higher Fluorescence in Platinum(IV) Orthometallated Complexes of Perylene Imine Compared with their Platinum(II) or Palladium(II) Analogues». Dalton Trans., 2015, 44, 16164-16176. Doi: 10.1039/c5dt02572a. |
| G. Aullón, M. Crespo, M. Font-Bardía, J. Jover, M. Martínez and J. Pike, «A Combined Kinetico-mechanistic and Computational Study on the Competitive Formation of Seven- versus Five-membered Platinacycles; the Relevance of Spectator Halide Ligands». Dalton Trans., 2015, 44 17968-17979. Doi: 10.1039/c5dt02657a. |
| C. Fliedel, V. Rosa, A. Falceto, P. Rosa, S. Alvarez and P. Braunstein, «Substituent Effects in N-(thioether)-Functionalized Bis(Diphenylphosphino)amine-type Ligands on the Coordination Sphere of Iron(II) Complexes: Structures, Magnetism and Bonding». Inorg. Chem., 2015, 54, 6547-6559. Doi: 10.1021/acs.inorgchem.5b00834. |
| J. Fernández-Valparís and S. Alvarez. «Design of a Structural Database for Homoleptic Transition Metal Complexes». Struct. Chem., 2015, 26, 1715-1723. Doi:10.1007/s11224-015-0651-3. |
| G. Aullón and B. Peigné. «Structural Analysis of the Coordination of Dinitrogen to Transition Metal Complexes”. Acta Cryst., Sect B, 2015, 71, 369-386. Doi: 10.1107/S2052520615006083. |
| C. M. Alvarez, G. Aullón, H. Barbero, L. A. García-Escudero, C. Martínez-Pérez, J. M. Martín-Alvarez and D. Miguel. «Assembling Nonplanar Polyaromatic Units by Click Chemistry. Study of Multicorannulene Systems as Host for Fullerenes”. Org. Lett., 2015, 17, 2578-2581. Doi: 10.1021/acs.orglett.5b01161. |
| A. Mondragón, M. Flores-Alamo, P. R. Martínez-Alanis, G. Aullón, V. M. Ugalde-Saldívar and I. Castillo. «Electrocatalytic Proton Reduction by Dimeric Nickel Complex of a Sterically Demanding Pincer-type NS2Aminobis(thiophenolate) Ligand”. Inorg. Chem., 2015, 54, 619−627. |
| N. Bridonneau, J. Long, J.-L. Cantin, J. von Bardeleben, S. Pillet, E.-E. Bendeif, D. Aravena, E. Ruiz, V. Marvaud. «First evidence of light- induced spin transition in molybdenum(IV)». Chem. Commun., 2015, 51, 8229-8232. |
| S. Gómez-Coca, D. Aravena, R. Morales, E. Ruiz. «Large magnetic anisotropy in mononuclear metal complexes». Coord. Chem. Rev., 2015, 289-290, 379-392. |
| S. Das, K. S. Bejoymohandas, A. Dey, S. Biswas, M. L. P. Reddy, R. Morales, E. Ruiz, S. Titos-Padilla, E. Colacio, V. Chandrasekhar. «Amending the Anisotropy Barrier and Luminescence Behavior of Heterometallic Trinuclear Linear [MII– LnIII– MII] (LnIII = Gd, Tb, Dy; MII = Mg /Zn) Complexes by Change from Divalent Paramagnetic to Diamagnetic Metal Ions». Chem. Eur. J., 2015, 21, 6449-6464. |
| M. Lupu, A. Zaulet, F. Teixidor, E. Ruiz and C. Viñas. «Negatively Charged Metallacarborane Redox Couples with Both Members Stable to Air». Chem. Eur. J. 2015, 21, 6888-6897. |
| S. Canton, X. Zhang, L. Lawson Daku, Y. Liu, J. Zhang and S. Alvarez. «Mapping the Ultrafast Changes of Continuous Shape Measures in Photoexcited Spin Crossover Complexes without Long-Range Order». J. Phys. Chem. C. 2015, 119, 3322-3330. Doi:10.1021/jp5117189. |
| S. Shaik and S. Alvarez. Reply to «Entropic factors also contribute to the high melting points of polyhedral alkanes». Nature Chem., 2015, 7, 87-90. |
| I. Sánchez-Lombardo, S. Alvarez, C. C. McLauchlan and D. C. Crans. «Evaluating Transition State Structures of vanadium-phosphatase protein complexes using shape analysis». J. Inorg. Biochem., 2015, 147, 153-164. Doi:10.1016/j.jinorgbio.2015.04.005. |
| M. Carrasco, I. Mendoza, E. Alvarez, C. Maya, R. Peloso, A. Rodríguez, A. Falceto, S. Alvarez and E. Carmona. «Experimental and Computational Studies of the Molybdenum-Flanking Arene Interaction in Quadruply Bonded Dimolybdenum Complexes with Terphenyl Ligands». Chem. Eur. J., 2015, 21, 410-421. Doi: 10.1002/chem.201404057 |
| L. J. K. Cook, R. Mohammed, G. Sherborne, S. Alvarez and M. Halcrow, “Spin-state Behaviour of Iron(II)Dipyrazolylpyridine Complexes. New Insights from Crystallographic and Solution Measurements». Coord. Chem. Rev., 2015, 289-290, 2-12. Doi: 10.1016/j.ccr.2014.08.006. |