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Publications

2024

Catalytic function of ionic liquids in polyethylene terephthalate glycolysis by molecular dynamics simulations
M.A. Nosir, M.A. Ortuño

Mapping the Slow Stabilization of End States with Length along a Laterally Extended Graphene Nanoribbon
U. Thupakula, W.-H. Soe, J. Castro-Esteban, A. Al Saati, G. Trinquier, X. Bouju, D. Peña, C. Joachim

Cyano-Polycyclic Aromatic Hydrocarbon Interstellar Candidates: Laboratory Identification, Equilibrium Structure and Astronomical Search of Cyanobiphenylene
C. Cabezas, J. Janeiro, D. Pérez, W. Li, M. Agúndez, A.L. Steber, E. Guitián, J. Demaison, C. Pérez, J. Cernicharo, A. Lesarri

Tuneable Current Rectification Through a Designer Graphene Nanoribbon
N. Friedrich, J. Li, I. Pozo, D. Peña, J.I. Pascual

Observation of SOMO-HOMO Inversion in a Neutral Polycyclic Conjugated Hydrocarbon
S. Mishra, M. Vilas-Varela, S. Fatayer, F. Albrecht, D. Peña, L. Gross

Bistability between π-diradical open-shell and closed-shell states in indeno[1,2-a]fluorene
S. Mishra, M. Vilas-Varela, L.-A. Lieske, R. Ortiz, S. Fatayer, I. Rončević, F. Albrecht, T. Frederiksen, D. Peña, L. Gross

Aryne-based synthesis of cyclobutadiene-containing oligoacenes and related extended biphenylene derivatives
B. Álvarez, J. Janeiro, A. Cobas, M.A. Ortuño, D. Peña, E. Guitián, D. Pérez

Tribological improvement of potential lubricants for electric vehicles using double functionalized graphene oxide as additives
J.M. Liñeira del Río, G. Alonso Pérez, A. Martínez, D. Peña, J. Fernández

Introducing Design Strategies to Preserve N-Heterocycles Throughout the On-Surface Synthesis of Graphene Nanostructures
M. Tenorio, C. Moreno, M. Vilas-Varela, J. Castro-Esteban, P. Febrer, M. Pruneda, D. Peña, A. Mugarza

The effect of water on gold supported chiral graphene nanoribbons: rupture of conjugation by an alternating hydrogenation pattern
A. Berdonces-Layunta, A. Matěj, A. Jiménez-Martín, J. Lawrence, M.S.G. Mohammed, T. Wang, B. Mallada, B. de la Torre, A. Martínez, M. Vilas-Varela, R. Nieman, H. Lischka, D. Nachtigallová, D. Peña, P. Jelínek, D.G. de Oteyza