Recent Publications

Stephanie Willeit, Alexander Mauz, David Gutiérrez-Armayor, Joseph Arbash, Jesús Agustín Banda-Vázquez, Sergio Martí, Pedro B. Coto, Rubén D. Costa (2025). Ancestral Protein-Based Lighting. Adv. Mater. 2025, 2420303.

Karin S. Thalmann, Kalith Mohamed Ismail Syed Sulaiman, R. K. Kathir, Diogo J. L. Rodrigues, Michael Thoss, Ángel Martín Pendás, Pedro B. Coto (2024). Role of the Radical Character in Singlet Fission: An Ab Initio and Quantum Chemical Topology Analysis. J. Phys. Chem. A 2025, 129, 1, 94-102.

R. K. Kathir, Pedro B. Coto, Michael Thoss (2024). Spin Mixing in Intramolecular Singlet Fission: A First-Principles-Based Quantum Dynamical Study. J. Phys. Chem. Lett. 2024, 15, 46, 11517–11524.

Tomas Stephen Northam de la Fuente, Irene Vettori, Kalith Mohamed Ismail Syed Sulaiman, Mattia Gaboardi, V. Di Lisio, D. Cangialosi, Pedro B. Coto, A. Otero-De-La-Roza, Felix Fernandez-Alonso (2024). New materials for the recovery and storage of thermal energy. EPJ Web of Conferences 310, 00008 (2024).

A. Scognamiglio, K. S. Thalmann, S. Hartweg, N. Rendler, L. Bruder, Pedro B. Coto, M. Thoss, F. Stienkemeier (2024). Non-adiabatic electronic relaxation of tetracene from its brightest singlet excited state. J. Chem. Phys. 161, 024302 (2024).

Cristina Maciá-Castelló, Jennifer Huidobro, Daniel Blanco López, Mattia Gaboardi, Carlo Cazzaniga, Nahid Bhuiyan, Jorge S. Dolado, Gorka Arana, Juan Manuel Madariaga, Felix Fernandez-Alonso (2024). Neutron activation on NILE for quantitative chemical analysis – First results and outlook. EPJ Web of Conferences 298, 05002 (2024).

Ginevra Giobbio, Pedro B. Coto, Jean-François Lohier, Jean-Luc Renaud, Sylvain Gaillard, Rubén D. Costa (2024). [Ag(IPr)(bpy)][PF6]: brightness and darkness playing with aggregation induced phosphorescence for light-emitting electrochemical cells. Dalton Trans., 2024,53, 12307-12315.

S. Rajagopala Reddy, Pedro B. Coto, Michael Thoss (2024). Intramolecular singlet fission: Quantum dynamical simulations including the effect of the laser field. J. Chem. Phys. 160, 194306 (2024).

Stephanie Grümbel, Marco Hasler, Sara Ferrara, Marta Patrian, Jesús Agustín Banda-Vázquez, Pedro B. Coto, Juan Pablo Fuenzalida Werner, Rubén D. Costa (2024). Simple Encoded Circularly Polarized Protein Lighting. Adv. Optical Mater. 2024, 12, 2400106..

M. J. Coak, K. Götze, Tomas Stephen Northam de la Fuente, C. Castelnovo, J.P. Tidey, J. Singleton, A. T. Boothroyd, D. Prabhakaran, P. A. Goddard (2024). Magnetotransport of Sm2Ir2O7 across the pressure-induced quantum-critical phase boundary. npj Quantum Mater 2024, 9, 1–12.

Tomas Stephen Northam de la Fuente, Mattia Gaboardi, Kalith Mohamed Ismail Syed Sulaiman, Valerio Di Lisio, Daniele Cangialosi, Alberto Otero-De-La-Roza, Pedro B. Coto, Felix Fernandez-Alonso (2024). Metastability and polymorphism in dihydroxybenzenes – implications for thermal energy storage. Energy Adv., 2024,3, 413-418.

Kacper Drużbicki, Pablo Gila-Herranz, Pelayo Marín-Villa, Mattia Gaboardi, Jeff Armstrong, Felix Fernandez-Alonso (2024). Cation Dynamics as Structure Explorer in Hybrid Perovskites─The Case of MAPbI3. Cryst. Growth Des. 2024, 24, 391-404.

Valerio Di Lisio, Balthasar Braunewell, Cristina Maciá-Castelló, Margherita Simoni, Roberto Senesi, Felix Fernandez-Alonso, Daniele Cangialosi (2023). Fast scanning calorimetry on volatile carbon-based materials. Thermochimica Acta 719 (2023) 179414.

Pelayo Marín-Villa, Ana Arauzo, Kacper Drużbicki, Felix Fernandez-Alonso (2022). Unraveling the Ordered Phase of the Quintessential Hybrid Perovskite MAPbI3─Thermophysics to the Rescue. J. Phys. Chem. Lett. 2022, 13, 36, 8422–8428.

Mattia Gaboardi, Ian Silverwood, Balthasar Braunewell, Jay Siegel, Felix Fernandez-Alonso (2021). Emergence of dynamical disorder and phase metastability in carbon nanobowls. Carbon 2022, 183, 196-204.