Rémi Maurice

Identifiants chercheurs

IdHAL :

remi-maurice

ORCID :

0000-0003-2889-6518

IdRef :

161868061

Présentation

Publications

Article dans une revue (62)

Persistent mono-oxo bonding with protactinium(V) revealed in highly acidic chloride solutions Melody Maloubier,Tamara Shaaban,Florent Réal,C. Le Naour,Hanna Oheret al. Angewandte Chemie International Edition, 2026, 65 (11), pp.e18403. ⟨10.1002/anie.202518403⟩ Article dans une revue hal-05403877v1
Freed from Iron easy release of a stable ketene from the reaction of CO with di-iron bis-μ2-alkylidenes. Sandip Munshi,Raphaël Ravel-Massol,Ricardo Garcia-Serres,Nicolas Suaud,Rémi Mauriceet al. Chemical Communications, 2025, 61 (48), pp.8687-8690. ⟨10.1039/d5cc02019k⟩ Article dans une revue hal-05093537v1
Exchange Couplings and Magneto-Structural Correlations of Trinuclear MII-UIV-MII (MII=Co, Ni, Cu) Complexes Lotfi Belkhiri,Rémi Maurice,Boris Le Guennic,Abdou Boucekkine,Michel Ephritikhine European Journal of Inorganic Chemistry, 2024, 27 (14), pp.e202300788. ⟨10.1002/ejic.202300788⟩ Article dans une revue hal-04576827v1
The resolution of the weak-exchange limit made rigorous, simple and general in binuclear complexes Dumitru-Claudiu Sergentu,Boris Le Guennic,Rémi Maurice Physical Chemistry Chemical Physics, 2024, Physical Chemistry Chemical Physics, 26 (8), pp.6844-6861. ⟨10.1039/d3cp04943d⟩ Article dans une revue hal-04480522v1
Stability of the protactinium(V) mono-oxo cation probed by first-principle calculations Tamara Shaaban,Florent Réal,Rémi Maurice,Valérie Vallet Chemistry - A European Journal, 2024, 30 (15), pp.e202304068. ⟨10.1002/chem.202304068⟩ Article dans une revue hal-04329412v1
Is the protactinium(V) mono-oxo bond weaker than what we thought? Tamara Shaaban,Hanna Oher,Jean Aupiais,Julie Champion,André Severo Pereira Gomeset al. Chemical Communications, 2024, 60, pp.14376-14379. ⟨10.1039/D4CC04522J⟩ Article dans une revue hal-04690060v1
Excited states of polonium(IV ) : electron correlation and spin–orbit coupling in the Po&lt;sup&gt;4+&lt;/sup&gt; free ion andin the bare and solvated [PoCl&lt;sub&gt;5&lt;/sub&gt;]&lt;sup&gt;-&lt;/sup&gt; and [PoCl&lt;sub&gt;6&lt;/sub&gt;]&lt;sup&gt;2-&lt;/sup&gt; complexes Nadiya Zhutova,Florent Réal,Eric Renault,Valérie Vallet,Rémi Maurice Physical Chemistry Chemical Physics, 2023, 25, pp.24603-24612. ⟨10.1039/D3CP03317A⟩ Article dans une revue hal-04221261v1
Electronic Structure and Magneto-Structural Correlations Study of Cu2UL Trinuclear Schiff Base Complexes: A 3d-5f-3d Case Samir Meskaldji,Lotfi Belkhiri,Rémi Maurice,Karine Costuas,Boris Le Guennicet al. Journal of Physical Chemistry A, 2023, 127 (6), pp.1475-1490. ⟨10.1021/acs.jpca.2c08755⟩ Article dans une revue hal-04011284v1
Coordination and thermodynamic properties of aqueous protactinium(V) by first-principle calculations Hanna Oher,Jeremy Delafoulhouze,Eric Renault,Valérie Vallet,Rémi Maurice Physical Chemistry Chemical Physics, 2023, 25, pp.10033-10041. ⟨10.1039/D3CP00323J⟩ Article dans une revue hal-03951670v1
Antisymmetric Exchange in a Real Copper Triangular Complex Mohammed-Amine Bouammali,Nicolas Suaud,Nathalie Guihéry,Rémi Maurice Inorganic Chemistry, 2022, 61 (31), pp.12138-12148. ⟨10.1021/acs.inorgchem.2c00939⟩ Article dans une revue hal-03776943v1
Pourbaix diagram of astatine revisited: experimental investigations Lu Liu,Rémi Maurice,Nicolas Galland,Philippe Moisy,Julie Championet al. Inorganic Chemistry, 2022, 61 (34), pp.13462-13470. ⟨10.1021/acs.inorgchem.2c01918⟩ Article dans une revue hal-03776952v1
Geometries, interaction energies and bonding in [Po(H&lt;sub&gt;2&lt;/sub&gt;O)&lt;sub&gt;n&lt;/sub&gt;]&lt;sup&gt;4+&lt;/sup&gt; and [PoCl&lt;sub&gt;n&lt;/sub&gt;]&lt;sup&gt;4-n&lt;/sup&gt; complexes Nadiya Zhutova,Florent Réal,Valérie Vallet,Rémi Maurice Physical Chemistry Chemical Physics, 2022, 24, pp.26180-26189. ⟨10.1039/d2cp04001h⟩ Article dans une revue hal-03768316v1
Characterization of Uranyl Coordinated by Equatorial Oxygen: Oxo in UO$_3$ versus Oxyl in UO$_3^+$ Eric Renault,Jiwen Jian,Rémi Maurice,Michael J. van Stipdonk,Irena J. Tatosianet al. Journal of Physical Chemistry A, 2021, 125 (25), pp.5544-5555. ⟨10.1021/acs.jpca.1c03818⟩ Article dans une revue hal-03323270v1
How to create giant Dzyaloshinskii–Moriya interactions? Analytical derivation and ab initio calculations on model dicopper(II) complexes Mohammed-Amine Bouammali,Nicolas Suaud,Rémi Maurice,Nathalie Guihéry The Journal of Chemical Physics, 2021, 154 (13), pp.134301. ⟨10.1063/5.0045569⟩ Article dans une revue hal-03191170v1
Extraction of giant Dzyaloshinskii–Moriya interaction from ab initio calculations: First-order spin–orbit coupling model and methodological study Mohammed-Amine Bouammali,Nicolas Suaud,Rémi Maurice,Nathalie Guihéry The Journal of Chemical Physics, 2021, 155 (16), pp.164305. ⟨10.1063/5.0065213⟩ Article dans une revue hal-03428828v1
Magnetic Anisotropy in a Cubane-like Ni$_4$ Complex: An Ab Initio Perspective Rémi Maurice Inorganic Chemistry, 2021, 60 (9), pp.6306-6318. ⟨10.1021/acs.inorgchem.1c00047⟩ Article dans une revue hal-03217634v1
La radiochimie théorique comme composante essentielle de la radiochimie moléculaire Rémi Maurice,Eléonor Acher,Nicolas Galland,André Severo Pereira Gomes,Dominique Guillaumontet al. L'Actualité Chimique, 2021, 460-461, pp.42-47 Article dans une revue hal-03172988v1
An expanded halogen bonding scale using astatine Lu Liu,Seyfeddine Rahali,Rémi Maurice,Cecilia Gomez Pech,Gilles Montavonet al. Chemical Science, 2021, 12 (32), pp.10855-10861. ⟨10.1039/d1sc02133h⟩ Article dans une revue hal-03312159v1
Towards a Stronger Halogen Bond Involving Astatine: Unexpected Adduct with Bu3PO Stabilized by Hydrogen Bonding Lu Liu,Ning Guo,Julie Champion,Jérôme Graton,Gilles Montavonet al. Chemistry - A European Journal, 2020, 26 (17), pp.3713-3717. ⟨10.1002/chem.201905389⟩ Article dans une revue hal-03095955v1
Quantum chemical topology at the spin–orbit configuration interaction level: Application to astatine compounds Cecilia Gomez Pech,Pi A.B. Haase,Dumitru‐claudiu Sergentu,Anastasia Borschevsky,Julien Pilméet al. Journal of Computational Chemistry, 2020, 41 (23), pp.2055-2065. ⟨10.1002/jcc.26373⟩ Article dans une revue hal-02927706v1
Controlling Cation-Cation Interactions in Uranyl Coordination Dimers by Varying the Length of the Dicarboxylate Linker Rémi Maurice,Phuong D Dau,Maxime Hodée,Eric Renault,John K Gibson European Journal of Inorganic Chemistry, 2020, ⟨10.1002/ejic.202000840⟩ Article dans une revue hal-03370975v1
Relevance of effective bond orders in heterodiatomic molecules and role of the spin-orbit coupling in the AtX (X=At–F) series Cecilia Gomez Pech,Pi A.B. Haase,Nicolas Galland,Anastasia Borschevsky,Rémi Maurice Physical Review A, 2019, 100 (3), pp.032518. ⟨10.1103/PhysRevA.100.032518⟩ Article dans une revue hal-02327747v1
UV–Vis Absorption Spectroscopy of Polonium(IV) Chloride Complexes: An Electronic Structure Theory Study Ange Stoïanov,Julie Champion,Rémi Maurice Inorganic Chemistry, 2019, 58 (10), pp.7036-7043. ⟨10.1021/acs.inorgchem.9b00668⟩ Article dans une revue hal-02150692v1
Influence of ancillary ligands and solvents on the nuclearity of Ni–Ln complexes Jean- Pierre Costes,Sonia Mallet-Ladeira,Laure Vendier,Rémi Maurice,Wolfgang Wernsdorfer Dalton Transactions, 2019, 48 (10), pp.3404-3414. ⟨10.1039/c9dt00370c⟩ Article dans une revue hal-02063674v1
Experimental and computational evidence of halogen bonds involving astatine Ning Guo,Rémi Maurice,David Teze,Jérôme Graton,Julie Championet al. Nature Chemistry, 2018, 10 (4), pp.428 - 434. ⟨10.1038/s41557-018-0011-1⟩ Article dans une revue in2p3-01769551v1
The bonding picture in hypervalent XF&lt;sub&gt;3&lt;/sub&gt; (X = Cl, Br, I, At) fluorides revisited with quantum chemical topology Mohamed Amaouch,Dumitru-Claudiu Sergentu,David Steinmetz,Rémi Maurice,Nicolas Gallandet al. Journal of Computational Chemistry, 2017, 38, pp.2753 - 2762. ⟨10.1002/jcc.24905⟩ Article dans une revue in2p3-01628255v1
Targeted radionuclide therapy with astatine-211: Oxidative dehalogenation of astatobenzoate conjugates David Teze,Dumitru-Claudiu Sergentu,Valentina Kalichuk,Jacques Barbet,David Deniaudet al. Scientific Reports, 2017, 7 (1), ⟨10.1038/s41598-017-02614-2⟩ Article dans une revue hal-03346519v1
Advances on the determination of the astatine Pourbaix diagram: Predomination of AtO(OH)&lt;sub&gt;2&lt;/sub&gt;&lt;sup&gt;−&lt;/sup&gt; over At&lt;sup&gt;−&lt;/sup&gt; in basic conditions Dumitru-Claudiu Sergentu,David Teze,Andrea Sabatié-Gogova,Cyrille Alliot,Ning Guoet al. Chemistry - A European Journal, 2016, 22, pp.2964-2971. ⟨10.1002/chem.201504403⟩ Article dans une revue istex in2p3-01274072v1
211 At-labeled agents for alpha-immunotherapy: On the in vivo stability of astatine-agent bonds Tahra F Ayed,Julien Pilmé,David Teze,Fadel Bassal,Jacques F Barbetet al. European Journal of Medicinal Chemistry, 2016, 116, pp.156 - 164. ⟨10.1016/j.ejmech.2016.03.082⟩ Article dans une revue istex inserm-01414904v1
Tools for predicting the nature and magnitude of magnetic anisotropy in transition metal complexes: Application to Co(II) complexes Benjamin Cahier,Rémi Maurice,Hélène Bolvin,Talal Mallah,Nathalie Guihéry Magnetochemistry, 2016, 2, pp.31. ⟨10.3390/magnetochemistry2030031⟩ Article dans une revue in2p3-01351335v1
Heptavalent Neptunium in a Gas-Phase Complex: (Np&lt;sup&gt;VII&lt;/sup&gt;O&lt;sub&gt;3&lt;/sub&gt;&lt;sup&gt;+&lt;/sup&gt;)(NO&lt;sub&gt;3&lt;/sub&gt;&lt;sup&gt;–&lt;/sup&gt;)&lt;sub&gt;2&lt;/sub&gt; Phuong D. Dau,Rémi Maurice,Eric Renault,John K. Gibson Inorganic Chemistry, 2016, 55, pp.9830-9837. ⟨10.1021/acs.inorgchem.6b01617⟩ Article dans une revue in2p3-01375624v1
Adsorbate-induced changes in magnetic interactions in Fe&lt;sub&gt;2&lt;/sub&gt;(dobdc) with adsorbed hydrocarbon molecules Pragya Verma,Rémi Maurice,D.G. Truhlar Journal of Physical Chemistry C, 2016, 120, pp.9933-9948. ⟨10.1021/acs.jpcc.6b03240⟩ Article dans une revue in2p3-01323355v1
Unraveling the hydration-induced ground-state change of AtO&lt;sup&gt;+&lt;/sup&gt; by relativistic and multiconfigurational wave-function-based methods Dumitru-Claudiu Sergentu,Florent Réal,Gilles Montavon,Nicolas Galland,Rémi Maurice Physical Chemistry Chemical Physics, 2016, 18, pp.32703-32712. ⟨10.1039/C6CP05028J⟩ Article dans une revue in2p3-01447927v1
The Heaviest Possible Ternary Trihalogen Species, IAtBr&lt;sup&gt;−&lt;/sup&gt;, Evidenced in Aqueous Solution: An Experimental Performance Driven by Computations Ning Guo,Dumitru-Claudiu Sergentu,David Teze,Julie Champion,Gilles Montavonet al. Angewandte Chemie International Edition, 2016, 55, pp.15369-15372. ⟨10.1002/anie.201608746⟩ Article dans une revue istex in2p3-01405047v1
Scrutinizing &quot;invisible&quot; astatine: A challenge for modern density functionals Dumitru-Claudiu Sergentu,Grégoire David,Gilles Montavon,Rémi Maurice,Nicolas Galland Journal of Computational Chemistry, 2016, 37, pp.1345-1354. ⟨10.1002/jcc.24326⟩ Article dans une revue istex in2p3-01312975v1
Synthesis and Structures of Plutonyl Nitrate Complexes: Is Plutonium Heptavalent in PuO&lt;sub&gt;3&lt;/sub&gt;(NO&lt;sub&gt;3&lt;/sub&gt;)&lt;sub&gt;2&lt;/sub&gt;&lt;sup&gt;−&lt;/sup&gt; ? Rémi Maurice,Eric Renault,Yu Gong,Philip X. Rutkowski,John K. Gibson Inorganic Chemistry, 2015, 54, pp.2367-2373. ⟨10.1021/ic502969w⟩ Article dans une revue in2p3-01121844v1
Identifying the Interactions That Allow Separation of O&lt;sub&gt;2&lt;/sub&gt; from N&lt;sub&gt;2&lt;/sub&gt; on the Open Iron Sites of Fe&lt;sub&gt;2&lt;/sub&gt;(dobdc) Pragya Verma,Rémi Maurice,Donald G. Truhlar Journal of Physical Chemistry C, 2015, 119, pp.28499-28511. ⟨10.1021/acs.jpcc.5b10382⟩ Article dans une revue in2p3-01250172v1
Effective bond orders from two-step spin-orbit coupling approaches: The I&lt;sub&gt;2&lt;/sub&gt;, At&lt;sub&gt;2&lt;/sub&gt; , IO&lt;sup&gt;+&lt;/sup&gt;, and AtO&lt;sup&gt;+&lt;/sup&gt; case studies Rémi Maurice,Florent Réal,Andre Severo Pereira Gomes,Valérie Vallet,Gilles Montavonet al. The Journal of Chemical Physics, 2015, 142, pp.094305. ⟨10.1063/1.4913738⟩ Article dans une revue in2p3-01123856v1
Synergy and destructive interferences between local magnetic anisotropies in binuclear complexes Nathalie Guihéry,Renaud Ruamps,Rémi Maurice,Coen de Graaf AIP Conference Proceedings, 2015, 1702, pp.090015. ⟨10.1063/1.4938823⟩ Article dans une revue in2p3-01254056v1
Electronic structures and geometries of the XF&lt;sub&gt;3&lt;/sub&gt; (X = Cl, Br, I, At) fluorides Dumitru-Claudiu Sergentu,Mohamed Amaouch,Julien Pilmé,Nicolas Galland,Rémi Maurice The Journal of Chemical Physics, 2015, 143, pp.114306. ⟨10.1063/1.4930609⟩ Article dans une revue in2p3-01201552v1
Interplay between Local Anisotropies in Binuclear Complexes Renaud Ruamps,Rémi Maurice,Coen de Graaf,Nathalie Guihéry Inorganic Chemistry, 2014, 53, pp.4508-4516. ⟨10.1021/ic500180k⟩ Article dans une revue in2p3-00983068v1
CO&lt;SUB&gt;2&lt;/SUB&gt; Adsorption in Fe&lt;SUB&gt;2&lt;/SUB&gt;(dobdc): A Classical Force Field Parameterized from Quantum Mechanical Calculations Joshua Borycz,Li-Chiang Lin,Eric D. Bloch,Jihan Kim,Allison L. Dzubacket al. Journal of Physical Chemistry C, 2014, 118, pp.12230-12240. ⟨10.1021/jp500313j⟩ Article dans une revue in2p3-00981792v1
Role of the Metal in the Bonding and Properties of Bimetallic Complexes Involving Manganese, Iron, and Cobalt Stephen Tereniak,Rebecca K. Carlson,Laura Clouston,Victor G. Young,Eckhard Billet al. Journal of the American Chemical Society, 2014, 136, pp.1842 - 1855 Article dans une revue in2p3-01631070v1
Computational determination of the dominant triplet population mechanism in photoexcited benzophenone Dumitru-Claudiu Sergentu,Rémi Maurice,Remco W. A. Havenith,Ria Broer,Daniel Roca-Sanjuán Physical Chemistry Chemical Physics, 2014, 16, pp.25393-25403. ⟨10.1039/C4CP03277B⟩ Article dans une revue in2p3-01080854v1
Unusual structure, bonding and properties in a californium borate Matthew J. Polinski,Edward B. Garner,Rémi Maurice,Nora Planas,Jared T. Stritzingeret al. Nature Chemistry, 2014, 6, pp.387-392. ⟨10.1038/nchem.1896⟩ Article dans une revue in2p3-00966875v1
Theoretical determination of spin Hamiltonians with isotropic and anisotropic magnetic interactions in transition metal and lanthanide complexes. Rémi Maurice,Coen De Graaf,Nathalie Guihéry Physical Chemistry Chemical Physics, 2013, 15 (43), pp.18784-804. ⟨10.1039/c3cp52521j⟩ Article dans une revue hal-00906982v1
Thorium and Uranium Carbide Cluster Cations in the Gas Phase: Similarities and Differences between Thorium and Uranium Cláudia Pereira,Rémi Maurice,Ana F. Lucena,Shuxian Hu,Antonio P. Goncalveset al. Inorganic Chemistry, 2013, 52, pp.10968 - 10975. ⟨10.1021/ic401058b⟩ Article dans une revue in2p3-01631045v1
Giant Ising-type Magnetic Anisotropy in Trigonal Bipyramidal Ni(II) Complexes : Experiment and Theory. Renaud Ruamps,Rémi Maurice,L.J. Batchelor,Martial Boggio-Pasqua,Régis Guillotet al. Journal of the American Chemical Society, 2013, 135 (8), pp.3017-3026. ⟨10.1021/ja308146e⟩ Article dans une revue hal-00795681v1
Magnetic State of Pyrochlore Cd&lt;sub&gt;2&lt;/sub&gt;Os&lt;sub&gt;2&lt;/sub&gt;O&lt;sub&gt;7&lt;/sub&gt; Emerging from Strong Competition of Ligand Distortions and Longer-Range Crystalline Anisotropy Nikolay A Bogdanov,Rémi Maurice,Ioannis Rousochatzakis,Jeroen van den Brink,Liviu Hozoi Physical Review Letters, 2013, 110, pp.127206. ⟨10.1103/PhysRevLett.110.127206⟩ Article dans une revue in2p3-01629470v1
Origin of the Magnetic Anisotropy in Ni(II) and Co(II) Heptacoordinate Complexes. Renaud Ruamps,L.J. Batchelor,Rémi Maurice,Nayanmoni Gogoi,P. Jiménez-Lozanoet al. Chemistry - A European Journal, 2013, 19 (3), pp.950-956. ⟨10.1002/chem.201202492⟩ Article dans une revue istex hal-00779369v1
Single-Ion Magnetic Anisotropy and Isotropic Magnetic Couplings in the Metal–Organic Framework Fe&lt;sub&gt;2&lt;/sub&gt;(dobdc) Rémi Maurice,Pragya Verma,Joseph M. Zadrozny,Sijie Luo,Joshua Boryczet al. Inorganic Chemistry, 2013, 52, pp.9379 - 9389. ⟨10.1021/ic400953e⟩ Article dans une revue in2p3-01631034v1
First-principles study of magnetic interactions in cupric oxide Abdul-Muizz Pradipto,Rémi Maurice,Nathalie Guihéry,Coen de Graaf,Ria Broer Physical Review B: Condensed Matter and Materials Physics (1998-2015), 2012, 85, pp.014409/1-014409/7. ⟨10.1103/PhysRevB.85.014409⟩ Article dans une revue hal-00864154v1
Magnetic interactions in LiCu&lt;sup&gt;2&lt;/sup&gt;O&lt;sup&gt;2&lt;/sup&gt;: Single-chain versus double-chain models Rémi Maurice,Abdul-Muizz Pradipto,Coen de Graaf,Ria Broer Physical Review B: Condensed Matter and Materials Physics (1998-2015), 2012, 86, pp.24411. ⟨10.1103/PhysRevB.86.024411⟩ Article dans une revue in2p3-01631019v1
Pentacoordinate NiII Complexes: Preparation, Magnetic Measurements, and Ab Initio Calculations of the Magnetic Anisotropy Terms Jean- Pierre Costes,Rémi Maurice,Laure Vendier Chemistry - A European Journal, 2012, 18 (13), pp.4031-4040. ⟨10.1002/chem.201103641⟩ Article dans une revue istex hal-00869441v1
Theoretical determination of the zero-field splitting in copper acetate monohydrate. Rémi Maurice,Kanthen Sivalingam,Dmitry Ganyushin,Nathalie Guihéry,Coen de Graafet al. Inorganic Chemistry, 2011, 50 (13), pp.6229-36. ⟨10.1021/ic200506q⟩ Article dans une revue hal-00864012v1
Magnetic Anisotropy in NiII-YIII Binuclear Complexes: On the Importance of Both the First Coordination Sphere of the NiII Ion and the YIII Ion Belonging to the Second Coordination Sphere Rémi Maurice,Laure Vendier,Jean- Pierre Costes Inorganic Chemistry, 2011, 50 (21), pp.11075-11081. ⟨10.1021/ic201623e⟩ Article dans une revue hal-00869437v1
Pentanuclear cyanide-bridged complexes based on highly anisotropic Co(II) seven-coordinate building blocks: synthesis, structure, and magnetic behavior. Luke J. Batchelor,Marco Sangalli,Régis Guillot,Nathalie Guihéry,Rémi Mauriceet al. Inorganic Chemistry, 2011, 50 (23), pp.12045-52. ⟨10.1021/ic201534e⟩ Article dans une revue hal-00864146v1
Antisymmetric Magnetic Interactions in Oxo-Bridged Copper(II) Bimetallic Systems Rémi Maurice,A. M. Pradipto,Nathalie Guihéry,R. Broer,C. de Graaf Journal of Chemical Theory and Computation, 2010, 6 (10), pp.3092-3101. ⟨10.1021/ct100329n⟩ Article dans une revue hal-00864006v1
Magnetic anisotropy in binuclear complexes in the weak-exchange limit: From the multispin to the giant-spin Hamiltonian Rémi Maurice,Cohen de Graaf,Nathalie Guihéry Physical Review B: Condensed Matter and Materials Physics (1998-2015), 2010, 81 (21), pp.214427/1-214427/9. ⟨10.1103/PhysRevB.81.214427⟩ Article dans une revue hal-00863106v1
Magnetostructural relations from a combined ab initio and ligand field analysis for the nonintuitive zero-field splitting in Mn(III) complexes. Rémi Maurice,Coen de Graaf,Nathalie Guihéry The Journal of Chemical Physics, 2010, 133 (8), pp.084307/1-084307/12. ⟨10.1063/1.3480014⟩ Article dans une revue hal-00863114v1
Rigorous Extraction of the Anisotropic Multispin Hamiltonian in Bimetallic Complexes from the Exact Electronic Hamiltonian Rémi Maurice,Nathalie Guihéry,Roland Bastardis,Cohen de Graaf Journal of Chemical Theory and Computation, 2010, 6 (1), pp.55-65. ⟨10.1021/ct900473u⟩ Article dans une revue hal-00863055v1
Universal Theoretical Approach to Extract Anisotropic Spin Hamiltonians Rémi Maurice,Roland Bastardis,Cohen de Graaf,Nicolas Suaud,Talal Mallahet al. Journal of Chemical Theory and Computation, 2009, 5 (11), pp.2977-2984. ⟨10.1021/ct900326e⟩ Article dans une revue hal-00862784v1

Chapitre d'ouvrage (3)

Analytical Derivations for the Description of Magnetic Anisotropy in Transition Metal Complexes Rémi Maurice,Nicolas Suaud,Nathalie Guihéry Challenges and Advances in Computational Chemistry and Physics, 34, Springer Science and Business Media B.V., pp.63-110, 2023, ⟨10.1007/978-3-031-31038-6_2⟩ Chapitre d'ouvrage hal-04337940v1
Magnetism in Binuclear Compounds: Theoretical Insights Rémi Maurice,Talal Mallah,Nathalie Guihéry Kalck, P. Modes of Cooperative Effects in Dinuclear Complexes, 70, SPRINGER INTERNATIONAL PUBLISHING AG, pp.207-233, 2023, Topics in Organometallic Chemistry, 978-3-031-32250-1; 978-3-031-32249-5. ⟨10.1007/3418_2022_78⟩ Chapitre d'ouvrage hal-04335887v1
Zero-field splitting in transition metal complexes: Ab initio calculations, effective Hamiltonians, model Hamiltonians, and crystal-field models Rémi Maurice,R. Broer,Nathalie Guihéry,C. de Graaf Hanbook of Relativistic Quantum Chemistry, 2016, 978-3-642-41611-8. ⟨10.1007/978-3-642-41611-8_37-1⟩ Chapitre d'ouvrage in2p3-01323359v1

Thèse (1)

Zero-Field Anisotropic Spin Hamiltonians in First-Row Transition Metal Complexes: Theory, Models and Applications Rémi Maurice Chemical Sciences. Université Paul Sabatier - Toulouse III, 2011. English. ⟨NNT : ⟩ Thèse tel-00608878v1

HDR (1)

On the role of relativistic effects on the structural, physical and chemical properties of molecules and materials Rémi Maurice Theoretical and/or physical chemistry. Université de Nantes (UNAM), 2018 HDR tel-02308305v1