PUBLICATIONS

PEER-REVIEWED ARTICLES

35. Effect of the substituents on the nature and strength of lone pair-carbonyl interactions in acyl halides, J. D. Velasquez, J. Echeverría* and S. Alvarez; Cryst. Growth Des., 2019, in press.

34. Experimental and theoretical study on Pb···S and Pb···O σ-hole interactions in the crystal structures of Pb(II) complexesJ. D. Velasquez, G. Mahmoudi, E. Zangrando, A. V. Gurbanov, F. I. Zubkov, Y. Zorlu, A. Masoudiasl and J. Echeverría*; CrystEngComm, 2019, 21, 6018-6025.

33. Understanding the molecule-electrode interface for molecular spintronic devices: A computational and experimental study, L. R. Piquer, R. R. Sánchez, E. C. Sañudo and J. Echeverría*; Molecules, 2018, 23, 1441.

32. In(III)···In(III) short contacts: an unnoticed metallophilic interaction?, J. Echeverría*; Chem. Commun., 2018, 54, 6312-6315.

31. The interplay of non-covalent interactions determining the antiparallel conformation of (isocyanide)gold(I) dimers, J. Echeverría*; CrystEngComm., 2018, 20, 3987-3993.

30. Taming monomeric [Cu(η6-C6H6)]+ complex with silylene, N. Parvin, S. Pal, J. Echeverría*, S. Alvarez* and S. Khan*; Chem. Sci., 2018, 9, 4333-4337.

29. Intermolecular carbonyl-carbonyl interactions in transition metal complexes, J. Echeverría*; Inorg. Chem., 2018, 57, 5429-5437.

28. The n → π* interaction in metal complexes, J. Echeverría*; Chem. Commun., 2018, 54, 3061-3064.

27. Adsorption of terarylenes on Ag(111) and NaCl(001)/Ag(111): a scanning tunneling microscopy and density functional theory study, J. P. Dela Cruz Calupitan, O. Guillermet, O. Galangau, M. Yengui, J. Echeverría, X. Bouju, T. Nakashima, G. Rapenne*, R. Coratger* and T. Kawai*; J. Phys. Chem. C, 2018, 122, 5978-5991.

26. Noncovalent interactions in succinic and maleic anhydride derivatives, J. Echeverría*; Cryst. Growth Des., 2018, 18, 506-512.

25. The silane-methane dimer revisited: more than a dispersion-bound system?, J. Echeverría*; Phys. Chem. Chem. Phys., 2017, 19, 32663-32669.

24. Alkyl groups as electron density donors in π-hole bonding, J. Echeverría*; CrystEngComm, 2017, 19, 6289-6296.

23. Attractive PH···HP interactions revealed by state-of-the-art ab initio calculations, S. Yourdkhani, M. Jablonski* and J. Echeverría*; Phys. Chem. Chem. Phys., 2017, 19, 28044-28055.

22. Frustrated Lewis trios and long-range hole-interactions: a combined structural and theoretical study of LB-AX3···LB and LB···AX3···LB (A = B, Al, Ga, In) systems, J. Echeverría*; ChemPhysChem, 2017, 18, 2864 -2872.

21. Intermolecular interactions in group 14 hydrides: beyond C-H···H-C contacts, J. Echeverría*, G. Aullón and S. Alvarez; Int. J. Quantum Chem., 2017; 117:e25432.

20. Zn-Zn double bonds, a theoretical study, J. Echeverría*, A. Falceto and S. Alvarez*; Angew. Chem. Int. Ed., 2017, 56, 10151-10155.

19. Mercurophilic interactions: A theoretical study on the importance of ligands, J. Echeverría*, J. Cirera and S. Alvarez; Phys. Chem. Chem. Phys., 2017, 19, 11645- 11654.

18. Abundance and strength of M-H···H-C (M = Al, Ga, In, Tl) dihydrogen bonds, J. Echeverría*; Cryst. Growth Des., 2017, 17, 2097-2103.

17. Dihydrogen intermolecular contacts in group 13 compounds: H···H or E···H (E = B, Al, Ga) interactions?, J. Echeverría*, G. Aullón and S. Alvarez; Dalton Trans., 2017, 46, 2844-2854.

16. Simultaneous and coordinated rotational switching of all molecular rotors in a network, Y. Zhang, H. Kersell, R. Stefak, J. Echeverría, V. Iancu, U. G. E. Perera, Y. Li, A. Deshpande, K. –F. Braun, C. Joachim*, G. Rapenne* and S. –W. Hla*, Nature Nanotechnol., 2016, 11, 706-712.

15. Current-driven supramolecular motor with in-situ surface chiral directionally switching, P. Mishra, J. Hill, S. Vijayaraghavan, W. van Rossom, S. Yoshizawa, M. Grisolia, J. Echeverría, T. Ono, K. Ariga, T. Nakayama, C. Joachim* and T. Uchihashi*; Nano Letters, 2015, 15, 4793-4798.

14. Supramolecular rotor and translator at work: On-surface movement of single atoms, R. Ohmann, J. Meyer, A. Nickel, J. Echeverría, M. Grisolia, C. Joachim*, F. Moresco* and G. Cuniberti*; ACS Nano, 2015, 9, 8394-8400.

13. Seeding of molecular spinners on a passivated silicon surface, J. Yang, A. Mahmood, J. Echeverría, O. Guillermet, J. Jeannoutot, S. Gauthier, C. Joachim*, F. Chérioux* and F. Palmino*; ChemPhysChem, 2014, 15, 271-275.

12. One-way rotation of a molecule-motor driven by a shot noise, J. Echeverría*, S. Monturet and C. Joachim; Nanoscale, 2014, 6, 2793-2799.

11. Understanding the Nature of the CH···HC Interactions in Alkanes, D. Danovich, S. Shaik*, F. Neese, J. Echeverría, G. Aullón and S. Alvarez*; J. Chem. Theory Comput., 2013, 9, 1977-1991.

10. Controlled Clockwise and Anticlockwise Rotational Switching of a Molecular Motor, U. G. E. Perera, F. Ample, H. Kersell, Y. Zhang, G. Vives, J. Echeverría, M. Grisolia, G. Rapenne*, C. Joachim* and S. -W. Hla*; Nature Nanotechnol., 2013, 8, 46- 51.

9. A Luminiscent Linear Trinuclear Dy(III) Complex Exhibiting Slow Magnetic Relaxation of Single Ion Origin, C. S. Liu, M. Du, E. C. Sañudo, J. Echeverría, M. Hu, Q. Zhang, L. M. Zhou and S. M. Fang*; Dalton Trans., 2011, 37, 9366-9369.

8. Dihydrogen Contacts in Alkanes are Subtle but not Faint, J. Echeverría, G. Aullón, D. Danovich, S. Shaik* and S. Alvarez*; Nature Chem., 2011, 2, 323-330.

7. Concurrent Symmetries: The Interplay Between Local and Global Molecular Symmetry, J. Echeverría, A. Carreras, D. Casanova, P. Alemany and S. Alvarez*; Chem. Eur. J., 2011, 17, 359-367.

6. The Trigonal Prism in Coordination Chemistry, E. Cremades, J. Echeverría and S. Alvarez*; Chem. Eur. J., 2010, 16, 10380-10396.

5. New Perspectives on Polyhedral Molecules and their Cristal Structures, S. Alvarez* and J. Echeverría; J. Phys. Org. Chem., 2010, 23, 1080-1087.

4. Jahn-Teller Distortions of Six-Coordinate CuII Compounds: cis or trans?, J. Echeverría, E. Cremades, A. J. Amoroso and S. Alvarez*; Chem. Commun., 2009, 4242-4244.

3. Covalent Radii Revisited, B. Cordero, V, Gómez, A. E. Platero-Prats, M. Revés, J. Echeverría, F, Barragán and S. Alvarez*; Dalton Trans., 2008, 2832-2838. “Hot Article”; highlighted in Chemical Science; highlighted in Chem. Eng. News, 28th April 2008; most on-line accessed article in 2008 (Dalton Trans., 2009, 15-17)

2. Molecules and Crystals with Both Icosahedral and Cubic Symmetry, J. Echeverría, D. Casanova, M. Llunell, P. Alemany and S. Alvarez*; Chem. Commun., 2008, 2717-2725. (Feature Article).

1. Application of Symmetry Operation Measures in Structural Inorganic Chemistry, J. Echeverría and S. Alvarez*; Inorg. Chem., 2008, 47, 10965-10970.

BOOK CHAPTERS

· Single molecular motors and gears based on star-shaped ruthenium complexes, R. Stefak, J. Echeverría, C. Joachim and G. Rapenne, in “Single Molecular Machines and Motors”, Springer, Berlin, 2015.

· The design of a single-molecule motor, J. Echeverría and C. Joachim, in “Single Molecular Machines and Motors”, Springer, Berlin, 2015.