Mercè Deumal

13PUBLICATIONS
25CO-AUTHORS
Metal organic frameworksOrganic semiconductorsTheory and design of materialsTheoretical quantum chemistryMolecular and organic electronics
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Journal

Publications (13)

|Feb 26, 2026
Stable 1,3,2-Benzodithiazolyl Radicals: Modification of Reactivity, Crystal Packing, and Solid State Magnetic Properties by Fluorination.

Alexander A Buravlev, Alexander Yu Makarov, Jordi Ribas-Ariño

|Jun 17, 2025
Rational Design of Electric Field-Responsive Building Blocks for All-Organic 2D Magnetoelectric Materials.

Kílian Jutglar-Lozano, Mercè Deumal, Jordi Ribas-Arino

|Dec 04, 2024
Rational design of organic diradicals with robust high-spin ground state based on antiaromatic linkers.

Raul Santiago, M Àngels Carvajal, Jordi Poater

|Nov 27, 2024
Real-Time CASSCF (Ehrenfest) Modeling of Electron Dynamics in Organic Semiconductors. Dynamics Reaction Paths Driven by Quantum Coherences. Application to a Radical Organic Semiconductor.

Mercè Deumal, Jordi Ribas-Ariño, Cristina Roncero

|Mar 26, 2024
Enhancing Intramolecular Ferromagnetic Coupling in Tetrathiafulvalene-Nitronyl Nitroxide-Based Compounds through Spin Polarization Mechanism.

Pau Franquesa-Viñas, Jordi Ribas-Ariño, Raul Santiago

|Mar 21, 2023
Satellite ligand effects on magnetic exchange in dimers. A structural, magnetic and theoretical investigation of Cu2L2X4 (L = methylisothiazolinone and X = Cl-, Br-).

Stefan Coetzee, Mark M Turnbull, Christopher P Landee

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Frequent Collaborators

5 joint publications

Jordi Ribas-Ariño

3 joint publications

Ibério de P R Moreira

3 joint publications

Mark M Turnbull

3 joint publications

Stefan T Bromley