Impact of the electric field on isotropic and anisotropic spin Hamiltonian parameters von Pradines, Barthélémy, Cahier, Benjamin, Suaud, Nicolas, Guihéry, Nathalie

Volltext

Cyano-Bridged Fe(II)–Cr(III) Single-Chain Magnet Based on Pentagonal Bipyramid Units: On the Added Value of Aligned Axial Anisotropy von Pichon, Céline, Suaud, Nicolas, Duhayon, Carine, Guihéry, Nathalie, Sutter, Jean-Pascal

Volltext

Physical origin of the anisotropic exchange tensor close to the first-order spin–orbit coupling regime and impact of the electric field on its magnitude von Heully-Alary, Flaurent, Pradines, Barthélémy, Suaud, Nicolas, Guihéry, Nathalie

Volltext

Extraction of giant Dzyaloshinskii–Moriya interaction from ab initio calculations: First-order spin–orbit coupling model and methodological study von Bouammali, Mohammed-Amine, Suaud, Nicolas, Maurice, Rémi, Guihéry, Nathalie

Volltext

How to create giant Dzyaloshinskii–Moriya interactions? Analytical derivation and ab initio calculations on model dicopper(II) complexes von Bouammali, Mohammed-Amine, Suaud, Nicolas, Martins, Cyril, Maurice, Rémi, Guihéry, Nathalie

Volltext

Universal Theoretical Approach to Extract Anisotropic Spin Hamiltonians von Maurice, Rémi, Bastardis, Roland, Graaf, Coen de, Suaud, Nicolas, Mallah, Talal, Guihéry, Nathalie

Volltext

Difficulty of the evaluation of the barrier height of an open-shell transition state between closed shell minima: The case of small C4n rings von David, Grégoire, Ben Amor, Nadia, Zeng, Tao, Suaud, Nicolas, Trinquier, Georges, Malrieu, Jean-Paul

Volltext

Understanding the impact of correlation on bond length alternation in polyenes von Suaud, Nicolas, Ben Amor, Nadia, Guihéry, Nathalie, Malrieu, Jean-Paul

Volltext

From Positive to Negative Zero-Field Splitting in a Series of Strongly Magnetically Anisotropic Mononuclear Metal Complexes von Novitchi, Ghénadie, Jiang, Shangda, Shova, Sergiu, Rida, Fatima, Hlavička, Ivo, Orlita, Milan, Wernsdorfer, Wolfgang, Hamze, Rana, Martins, Cyril, Suaud, Nicolas, Guihéry, Nathalie, Barra, Anne-Laure, Train, Cyrille

Volltext

Study of the Electronic Structure of NiGa2S4 and Extraction of the Spin Hamiltonian Parameters from Ab Initio Calculations von Pradines, Barthélémy, Lacombe, Lionel, Guihéry, Nathalie, Suaud, Nicolas

Volltext

Engineering the magnetic coupling and anisotropy at the molecule–magnetic surface interface in molecular spintronic devices von Campbell, Victoria E., Tonelli, Monica, Cimatti, Irene, Moussy, Jean-Baptiste, Tortech, Ludovic, Dappe, Yannick J., Rivière, Eric, Guillot, Régis, Delprat, Sophie, Mattana, Richard, Seneor, Pierre, Ohresser, Philippe, Choueikani, Fadi, Otero, Edwige, Koprowiak, Florian, Chilkuri, Vijay Gopal, Suaud, Nicolas, Guihéry, Nathalie, Galtayries, Anouk, Miserque, Frederic, Arrio, Marie-Anne, Sainctavit, Philippe, Mallah, Talal

Volltext

Electrically Switchable Magnetic Molecules: Inducing a Magnetic Coupling by Means of an External Electric Field in a Mixed-Valence Polyoxovanadate Cluster von Cardona-Serra, Salvador, Clemente-Juan, Juan M., Coronado, Eugenio, Gaita-Ariño, Alejandro, Suaud, Nicolas, Svoboda, Ondrej, Bastardis, Roland, Guihéry, Nathalie, Palacios, Juan J.

Volltext

Light-Induced Excited Spin State Trapping: Ab Initio Study of the Physics at the Molecular Level von Suaud, Nicolas, Bonnet, Marie-Laure, Boilleau, Corentin, Labèguerie, Pierre, Guihéry, Nathalie

Volltext

Theoretical Design of High-Spin Polycyclic Hydrocarbons von Trinquier, Georges, Suaud, Nicolas, Malrieu, Jean-Paul

Volltext

A Trinuclear Co(II) Complex Based on the Tris-Dioxolene Triphenylene Non-Innocent Bridge: Complementary Redox, Magnetic Behavior and Theoretical Calculations von Colin, Aristide, Wang, Yiting, Lambert, François, Bridonneau, Nathalie, Suaud, Nicolas, Guillot, Régis, Rivière, Eric, Halime, Zakaria, Guihéry, Nathalie, Ohkoshi, Shin-ichi, Mallah, Talal

Volltext

A Wigner molecule at extremely low densities: a numerically exact study von Escobar Azor, Miguel, Brooke, Léa, Evangelisti, Stefano, Leininger, Thierry, Loos, Pierre-François, Suaud, Nicolas, Berger, Arjan

Volltext

Pentagonal Bipyramid FeII Complexes: Robust Ising‐Spin Units towards Heteropolynuclear Nanomagnets von Bar, Arun Kumar, Gogoi, Nayanmoni, Pichon, Céline, Goli, V. M. L. Durga Prasad, Thlijeni, Mehrez, Duhayon, Carine, Suaud, Nicolas, Guihéry, Nathalie, Barra, Anne‐Laure, Ramasesha, S., Sutter, Jean‐Pascal

Volltext

Designing Magnetic Organic Lattices from High-Spin Polycyclic Units von Trinquier, Georges, Suaud, Nicolas, Guihéry, Nathalie, Malrieu, Jean-Paul

Volltext

Determining Key Local Vibrations in the Relaxation of Molecular Spin Qubits and Single-Molecule Magnets von Escalera-Moreno, L, Suaud, N, Gaita-Ariño, A, Coronado, E

Volltext

Electron Delocalization in Mixed-Valence Keggin Polyoxometalates. Ab Initio Calculation of the Local Effective Transfer Integrals and Its Consequences on the Spin Coupling von Suaud, Nicolas, Gaita-Ariño, Alejandro, Clemente-Juan, Juan Modesto, Sánchez-Marín, José, Coronado, Eugenio

Volltext