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Publications

2025

  • Disentangling Brillouin’s Negentropy Law of Information and Landauer’s Law on Data Erasure
    • Lairez Didier
    Entropy, MDPI, 2025, 28 (1), pp.37. The link between information and energy introduces the observer and their knowledge into the understanding of a fundamental quantity in physics. Two approaches compete to account for this link—Brillouin’s negentropy law of information and Landauer’s law on data erasure—which are often confused. The first, based on Clausius’ inequality and Shannon’s mathematical results, is very robust, whereas the second, based on the simple idea that information requires a material embodiment (data bits), is now perceived as more physical and therefore prevails. In this paper, we show that Landauer’s idea results from a confusion between information (a global emergent concept) and data (a local material object). This confusion leads to many inconsistencies and is incompatible with thermodynamics and information theory. The reason it prevails is interpreted as being due to a frequent tendency of materialism towards reductionism, neglecting emergence and seeking to eliminate the role of the observer. A paradoxical trend, considering that it is often accompanied by the materialist idea that all scientific knowledge, nevertheless, originates from observation. Information and entropy are actually emergent quantities introduced in the theory by convention. (10.3390/e28010037)
    DOI : 10.3390/e28010037
  • Zoïmorphisme
    • Desjardins Antoine
    • Rizza Giancarlo
    • Bozzi Hélène
    • Bianchini Samuel
    .able, Actar Publishers & École des Arts Décoratifs Paris, 2025 (31). Est-il possible de donner vie à un objet inanimé, tel un nouveau démiurge - en parabole du créateur présenté par Platon dans son Timée -, de le faire interagir avec son environnement proche, et d'évaluer la façon dont le public réagit à des formes non humaines et pourtant capables d'agentivité ? Zoïmorphisme est un programme de recherche-création visant à interroger la manière de concevoir et de mettre en œuvre des matériaux intelligents, qui répondent à des stimuli externes, afin de réaliser des créations artistiques actives révélant des formes de sensibilité et de vie (zoï [ζωή] en grec ancien). Les objets ainsi créés, les zoïmorphes, peuvent être activés par le spectateur par l'intermédiaire de capteurs, ce qui leur permet de se mouvoir et d'interagir avec d'autres zoïmorphes à proximité. À travers ce projet, l'humain et le non-humain sont amenés dans le même espace physique. La symbiose générée par le binôme constitué du spectateur et sa (de la) créature, permet de revisiter l'un des grands mythes classiques : celui du démiurge1 (δημιουργός) qui insuffle la vie à la matière informe. Ainsi, le projet Zoïmorphisme explore la création d'êtres sensibles non humains, formellement biosourcés, et de leur éveil par d'autres moyens que ceux du divin ou des biotechnologies. En sciences humaines et sociales, l'agentivité est définie par la capacité d'un objet à agir dans et sur l'environnement qui l'entoure. Zoïmorphisme vise à explorer artistiquement la relation entre une matière agentive et le moment où cette matière devient de la « matière grise » capable d'être active, réactive et adaptative. L'objet ainsi fabriqué est doté d'un comportement aux frontières de l'inerte, du vivant et de l'artificiel mouvant. Ces « choses » sont constituées de polymères magnétoactifs en caoutchouc naturel coloré intégrant des charges magnétiques (nanoparticules de magnétite [Fe3O4], limaille de Fe, microparticules de NdFeB et aimants) positionnées sur ce qui équivaudrait à des attaches musculaires ou des jonctions de fibres. Pour créer ou façonner ces objets à comportement, des techniques de fabrication additive par dépôt de fil fondu (FDM) et de moulage sont utilisées. Leurs morphologies, explicitement issues de l'hybridation de formes végétales et animales, peuvent se référer ou évoquer les échinodermes, les mollusques, voire les champignons ou les algues. L'utilisation de capteurs permet d'activer les propriétés magnétiques des zoïmorphes. Leurs mouvements non linéaires, ni programmés ni programmables, sont destinés à rappeler le comportement imprévisible des êtres vivants. Les combinaisons de géométries complexes et de comportements évolutifs permettent ainsi de repousser les limites de conception et de perception de l'animation du vivant, d'où surgissent des enjeux artistiques. En pensant la matière non pas comme une entité inerte, mais bien comme une sorte d'objet à comportement dont il faut prendre en compte la puissance d'agir, le projet explore la création de mondes artificiels, allusifs et dystopiques. (10.69564/able.fr.25031.zoimorphisme)
    DOI : 10.69564/able.fr.25031.zoimorphisme
  • Temperature and doping level effect on silicon thermal conductivity
    • Acosta Abanto Juan Carlos
    • Brouillard Mélanie
    • Sen Raja
    • Sjakste Jelena
    • Paulatto Lorenzo
    • Saint-Martin Jérôme
    • Vast Nathalie
    • Robillard J.F.
    • Horny Nicolas
    • Gomés Séverine
    • Chapuis Pierre-Olivier
    , 2025.
  • Encoding magnetic anisotropies in digital light processing 3D printing
    • Aïdonidis Eléonore
    • Cosola Andrea
    • Bourdon Pierre
    • Dammak Hichem
    • Sangermano Marco
    • Demoly Frédéric
    • Faustini Marco
    • Pérot Amélie
    • Lairez Didier
    • Mouhoubi Rakine
    • Blanquer Sébastien
    • Rizza Giancarlo
    Advanced Functional Materials, Wiley, 2025, 2025, pp.e23995. Magnetic fields are increasingly used in 4D printing to program matter across multiple length scales, enabling control over both macroscopic structures and nanoscale particle organization. However, their integration into additive manufacturing remains limited by compatibility constraints—such as interference with extrusion or optical access—and the inherent challenge of generating spatially resolved, dynamic magnetic fields. In this work, a digital light processing 3D printing method is introduced that directly encodes programmable magnetic anisotropy during fabrication. By formulating a photocurable resin with magnetic nanoparticles and liquid crystal monomers, composite structures are fabricated that respond to both magnetic and thermal stimuli. A hybrid magnetic system—combining a nested Halbach array with a coaxial coil placed in its inner cavity—enables real‐time, 3D control of magnetic fields (in both direction and intensity) during the printing process. This approach enables the alignment of liquid crystal mesogens, magnetic fillers, and the formation of vertically oriented nanoparticle chains. The resulting materials exhibit direction‐dependent actuation, shape reconfiguration, and selective conductivity, demonstrating a versatile platform for creating multifunctional and multi‐stimuli‐responsive devices. (10.1002/adfm.202523995)
    DOI : 10.1002/adfm.202523995
  • Étude approfondie de la réponse piézoélectrique de composites à base de PVDF soumis à un régime de large déformation pour la récupération d'énergie
    • Sigallon Marie
    , 2025. Flexibility and robustness have made the PVDF-based polymers worldwide studied piezoelectric materials for the design of novel autonomous piezoelectric generators. The race to achieve the best piezoperformances with PVDF and/or relatives is on.To better understand how material modifications act on the Figure of Merit of the piezoelectricity in polymers, our first consideration is that there is a huge difference of piezoelectric generator functioning between polymer films and solid crystals. In the case of polymers, the optimal piezoelectric response imposes the large deformation regime. Starting from the linear Curie’s constitutive equations, we have developed an analytical model to describe the piezoelectric response of a flexible piezomaterial. This model notably demonstrates a non-linear piezoelectric response with the applied pressure. The piezoelectric response should follow a power 2/3 of the mechanical excitation.To experimentally achieve a large bending regime with flexible piezopolymers, our newly mounted experimental set-up was adapted to a bulge testing configuration. Coupled with a sinusoidal mechanical excitation, it enabled us to confront theoretical results with experimental measurements.Mixing Swift-Heavy Ions (SHI) irradiations and Materials Science engineering on thin piezoPVDF films (dozens of microns) enables to multiply the elaboration of various PVDF-based composites. From nanoporous PVDF matrices obtained after ion-track-etching, it was thus possible to fill the etched ion-tracks with piezoelectric ZnO NWs, but also, hybrid nano-objects such as Metal Organic Frameworks (MOF). These new composites were characterized by FTIR, UV-visible spectrometry, FE-SEM, HR-TEM, AFM, XRD and dielectric permittivity measurements.A validation of our analytical model by experiments studying independently pure piezoPVDF film as reference and SHI nanostructured PVDF-based composites will be presented.
  • Arising of a bulk plasmon in the optical response of a WS 2 monolayer: an ab initio prediction confirmed experimentally
    • Andriambelaza Noeliarinala Felana
    • Sottile Francesco
    • Di Berardino Gaia
    • Noubiwo Laeticia
    • Chaste Julien
    • Oehler Fabrice
    • de Oliveira Nelson
    • Schué Léonard
    • Ouerghi Abdelkarim
    • Sirotti Fausto G
    • Giorgetti Christine
    , 2025. Ab initio formalisms allow state-of-the-art calculations to predict optical properties of materials. Time dependent density functional theory in reciprocal space is a robust and efficient framework for bulk crystalline materials, and it has been widely used to study the electronic excitations of isolated nano-objects. Several difficulties arise from the use of a supercell, coming both from the vacuum added to the object and from the interactions between artificial replicas. We recently proposed a framework to overcome both these problems, which predicts that the optical response of a two dimensional object is a linear combination of the absorption and the bulk plasmon resonances, namely the coexistence of a transverse and a longitudinal excitations. In this paper, we apply our formalism to monolayers of pristine WS2 and WSe2 and prove our theoretical findings by measuring the transmittance of these objects in the vacuum ultraviolet range for different incident angles of a polarized electromagnetic field.
  • Tunable electronic band structure in WS 2(1-x) Se 2x van der Waals Alloys
    • Bouaziz Meryem
    • Schué Léonard
    • Andriambelaza Noeliarinala Felana
    • Alyabyeva Natalia
    • Girard J.-C.
    • Dudin Pavel
    • Cadiz Fabian
    • Avila José
    • Dappe Y. J.
    • González César
    • Chaste Julien
    • Oehler Fabrice
    • Giorgetti Christine
    • Sirotti Fausto G
    • Ouerghi Abdelkarim
    Physical Review B, American Physical Society, 2025. <div><p>The electronic structure of semiconducting 2D materials such as transition metal dichalcogenides (TMDs) is known to be tunable by its environment, from simple external fields applied with electrical contacts up to complex van der Waals heterostructure assemblies. However, conventional alloying from reference binary TMD compounds to composition-controlled ternary alloys also offers unexplored opportunities. In this work, we use nano-angle resolved photoemission spectroscopy (nano-ARPES) and density functional theory (DFT) calculations to study the structural and electronic properties of different alloy compositions of bulk WS 2(1-x)Se2x.</p><p>Our results demonstrate the continuous variation of the band structure and the progressive evolution of the valence band splitting at the K points from 420 to 520 meV in bulk WS2(1-x)Se2x. We also carried out scanning tunneling microscopy (STM) measurements and DFT to understand the possible S or Se substitutions variants in WS2(1-x)Se2x alloys, with different local atomic configurations. Our work opens up perspectives for the fine control of the band dispersion in van der Waals materials and demonstrate how the band structure can be tuned in bulk TMDs. The collected information can serve as a reference for future applications.</p></div>
  • About carrier's self-trapping and dynamical Rashba splitting in the two-dimensional hybrid perovskite (BA)$_2$(MA)$_2$Pb$_3$I$_{10}$
    • Qi W.
    • Ponzoni S.
    • Huitric G.
    • Gorelov V.
    • Pramanik A.
    • Laplace Y.
    • Marsi M.
    • Papalazarou E.
    • Maehrlein S.
    • Deleporte E.
    • Mallik N.
    • Ibrahimi A. Taleb
    • Bendounan A.
    • Zheng K.
    • Pullerits T.
    • Perfetti L.
    , 2025. Time- and Angle-Resolved Photoelectron Spectroscopy (tr-ARPES) is employed to monitor photoexcited electrons in the two-dimensional hybrid perovskite (BA)$_2$(MA)$_2$Pb$_3$I$_{10}$. Photoelectron intensity maps are in good agreement with ab-initio calculations of the band structure. The effective mass is $-0.18 \pm 0.02 m_e$ and $0.12 \pm 0.02 m_e$ for holes and electrons, respectively. In the photoexcited state, spin-orbit splitting of the conduction band cannot be resolved. This sets the upper bound of photoinduced Rashba coupling to $α_C&lt;2.5$ eVÅ. The correlated electron-hole plasma evolves in Wannier excitons with Bohr radius of 2.5 nm, while no sign of self-trapping in small polarons is found within the investigated time window of up to 120 ps following photoexcitation. (10.48550/arXiv.2508.12129)
    DOI : 10.48550/arXiv.2508.12129
  • Picosecond anisotropic phase separation governing photoinduced phase stability in submicron Ti3O5 crystals
    • Mandal Ritwika
    • Lorenc Maciej
    • Cammarata Marco
    • Levantino Matteo
    • Zerdane S.
    • Janod Etienne
    • Cario Laurent
    • Tokoro Hiroko
    • Ohkoshi Shin-Ichi
    • Trzop Elzbieta
    • Servol Marina
    • Huitric Guénolé
    • Cailleau Hervé
    • Ta-Phuoc Vinh
    • Banhart Florian
    • Enachescu Cristian
    • Stoleriu Laurentiu
    • Mariette Céline
    Communications Materials, Nature, 2025, 6 (1), pp.209. Recently developed ceramic material Ti3O5 exhibits fascinating application properties, from ultrafast switching between metallic and insulating phases to light-to-heat conversion and storage. While the states conferring such properties are not spatially homogeneous, the origin of phase separation and the link between the phase coexistence and dynamics, key for stability of such states, is still little known. In this work, we use time-resolved X-ray diffraction and numerical simulations to establish rules by which the dynamics of heat-driven transition in laser excited Ti3O5 crystallites occur in space and time. The studies are conducted on submicron Ti3O5 crystallites and span a broad timescale allowing separation of phase change regimes. Our results reveal the influence of nanoscopic morphology on the mechanism of macroscopic transformation triggered by laser excitation. (10.1038/s43246-025-00896-y)
    DOI : 10.1038/s43246-025-00896-y
  • Chiral phonons
    • Juraschek Dominik
    • Geilhufe R. Matthias
    • Zhu Hanyu
    • Basini Martina
    • Baum Peter
    • Baydin Andrey
    • Chaudhary Swati
    • Fechner Michael
    • Flebus Benedetta
    • Grissonnanche Gael
    • Kirilyuk Andrei
    • Lemeshko Mikhail
    • Maehrlein Sebastian
    • Mignolet Maxime
    • Murakami Shuichi
    • Niu Qian
    • Nowak Ulrich
    • Romao Carl
    • Rostami Habib
    • Satoh Takuya
    • Spaldin Nicola
    • Ueda Hiroki
    • Zhang Lifa
    Nature Physics, Nature Publishing Group [2005-....], 2025, 21 (10), pp.1532-1540. (10.1038/s41567-025-03001-9)
    DOI : 10.1038/s41567-025-03001-9
  • Femtosecond-laser-delamination cavities for resonant acousto-magneto-plasmonics
    • Varlamov Pavel
    • Barros Akira
    • Swaminathan Aditya
    • Marx Jan
    • Ostendorf Andreas
    • Semisalova Anna
    • Makarov Denys
    • Lomonosov Alexey
    • Vavassori Paolo
    • Laplace Yannis
    • Raynaud Michele
    • Temnov Vasily
    Physical Review Letters, American Physical Society, 2025, 135 (12), pp.126904. Femtosecond lasers are routinely used for inducing local modification, including nanostructuring, and ultrafast laser spectroscopy in solids. However, these studies are often being performed separately making the unveiling of exciting physical properties of laser-fabricated materials out of reach. Here, we present an all-optical platform combining the fabrication of nano to micrometer size single-shot “femtosecond-laserdelamination” membranes or cavities of ferromagnetic thin films and multilayers together with their quasi in situ characterization using the Abbe-limited interferometric, ultrafast scanning photo-acoustic and magneto-plasmonic microscopies. Ferromagnetic nickel and iron cavities display high-Q acoustic resonances providing access to long-lived ultrahigh frequency coherent phonon modes in the above 100 GHz frequency range. Cavities in cobalt-gold bilayers allow for magnetically controlled surface plasmon resonance experiments in the Otto configuration, which is otherwise very difficult to implement experimentally. Quantitative experimental characterization of functional magnetic cavities, supported by the numerical modeling of all experimental data, opens an avenue to design and fabricate tunable nanoscaled femtosecond-laser-delamination architectures in thin films and multilayers. (10.1103/99sl-xxb2)
    DOI : 10.1103/99sl-xxb2
  • Structure and dynamics of Electronic states in layered quantum materials
    • Qi Weiyan
    , 2025. Layered materials possess unique band structures and physical properties that distinguish them from three-dimensional materials, attracting widespread research interest over the past decades. These distinctive features arise from the strong intralayer atomic bonding and relatively weak interlayer interactions. Therefore, tuning the atom types, intralayer structures, the interlayer interactions, or even stacking different types of materials can fundamentally change the macroscopic physical properties of the system. This thesis focuses on the electronic structure properties of two representative classes of layered materials: transition metal dichalcogenides (TMDs) and two-dimensional perovskites. Using angle-resolved photoemission spectroscopy (ARPES) and its time-resolved extension (tr-ARPES), in combination with electron diffraction, Raman spectroscopy, and transient reflectivity measurements, we systematically investigate complex electronic many body effects, chiral superlattice switching, and electron phonon coupling phenomena in these materials.
  • High-pressure, high-temperature phase equilibria with superhard boron-rich compounds of B-C-N-O and B-C-b–Si systems by in situ X-ray diffraction and CALPHAD methodology
    • Courac Alexandre
    • Le Godec Yann
    • Sjakste Jelena
    • Vast Nathalie
    • Rapaud Olivier
    • Turkevich Vladimir
    ACS Applied Materials & Interfaces, Washington, D.C. : American Chemical Society, 2025, 17 (38), pp.53013-53039. Boron-rich compounds within the B-C-N-O and B-C-Si systems exhibit exceptional functional properties, making them highly attractive for industrial applications such as those requiring superhardness, nuclear technologies, or thermoelectricity. This review summarizes recent experimental and theoretical advances on high-pressure, high-temperature (HPHT) phase equilibria up to 20 GPa and 3000 K, focusing on boron carbide (B 4 C), boron suboxide (B 6 O), boron subnitride (B 13 N 2 ), boron silicides and some of their solid solutions. Emphasis is placed on in situ x-ray diffraction (XRD), density functional theory (DFT) calculations and CALPHAD thermodynamic modeling. Despite recent progress, significant methodological challenges remain, requiring enhanced experimental accuracy and refined theoretical approaches. Future work should address these gaps to fully leverage the potential of these superhard materials. (10.1021/acsami.5c08312)
    DOI : 10.1021/acsami.5c08312
  • Online and in situ investigation of electron irradiation induced optical absorption in ZnGeP2 single crystals
    • Vernozy Charlotte
    • Alessi Antonino
    • Cavani Olivier
    • Courpron Audrey
    • Petit Johan
    • Véniard Valérie
    Nuclear Instruments and Methods in Physics Research Section B: Beam Interactions with Materials and Atoms, Elsevier, 2025, 566, pp.165758. In the present study, the absorbance induced in Zinc germanium diphosphide, ZnGeP 2 (ZGP) crystals and new Sn-doped ZGP crystals has been investigated under irradiation with high energy electrons. Online and in situ experiments were performed in the range 720-1100 nm. The spectra of the induced absorbance are constituted by a "tail" and the maximum appears to be located at wavelengths lower than those of the investigated spectral range. A fraction of the induced absorbance disappears within one minute after the electron beam is switched off, revealing the presence of metastable effects. A low and a high fluence contribution to the induced absorbance have been observed at 800 nm. The first reaches a limit value and seems to be affected by the Sn doping or by the absence of post-growth annealing, while the high fluence contribution does not feature a saturation in the investigated range and does not depend on the sample type. (10.1016/j.nimb.2025.165758)
    DOI : 10.1016/j.nimb.2025.165758
  • Direct measurement of the longitudinal exciton dispersion in h -BN by resonant inelastic X-ray scattering
    • Nicolaou Alessandro
    • Ruotsalainen Kari
    • Susana Laura
    • Porée Victor
    • Tizei Luiz Galvao
    • Koskelo Jaakko
    • Taniguchi Takashi
    • Watanabe Kenji
    • Zobelli Alberto
    • Gatti Matteo
    Physical Review B, American Physical Society, 2025, 112 (8), pp.085207. We report resonant inelastic X-ray scattering (RIXS) measurements on the prototypical hexagonal boron nitride (h-BN) layered compound. The RIXS results at the B and N K edges have been combined with electron energy loss spectroscopy (EELS) experiments and ab initio calculations within the framework of the Bethe-Salpeter equation of many-body perturbation theory. By means of this tight interplay of different spectroscopies, the lowest longitudinal exciton of h-BN has been identified. Moreover, its qualitatively different dispersions along the ΓK and the ΓM directions of the Brillouin zone have been determined. Our study advocates soft x-ray RIXS and EELS to be a promising combination to investigate electronic excitations in materials. (10.1103/wn39-b2sh)
    DOI : 10.1103/wn39-b2sh
  • Anomalous frequency scaling of acoustic phonon damping in freestanding nickel cavities fabricated via laser delamination
    • Viejo Rodríguez Alba
    • Rossetti Andrea
    • Gandolfi Marco
    • Urbina Elgueta Yoav
    • Modin Evgeny
    • Starikovskaia Svetlana
    • Chng Tat Loon
    • Temnov Vasily
    • Vincenti Maria Antonietta
    • Brida Daniele
    • Vavassori Paolo
    • Maccaferri Nicolò
    Applied Physics Letters, American Institute of Physics, 2025, 127 (7), pp.072201. Single-shot picosecond (ps) laser-induced delamination allows for the direct generation of suspended membranes from a continuous metallic film, offering a promising platform for the control of ultrafast magnetization dynamics driven by acoustic waves. Using the picosecond-ultrasonics method, we demonstrate that long-lived low-frequency acoustic waves can be optically excited in the delaminated cavities. At the same time, higher-frequency modes above 60 GHz exhibit a surprisingly fast damping, following a scaling law incompatible with the expected attenuation mediated by phonon–phonon scattering. Comparing measurements between delaminated cavities and a benchmark nickel film in contact with the substrate, we link our findings to structural modifications of the nickel crystal induced by the delamination process. (10.1063/5.0263631)
    DOI : 10.1063/5.0263631
  • Dose Rate Effects in Ag-Doped Metaphosphate Glass Radiophotoluminescent Dosimeters Up to MGy Range
    • Aguiar Y.
    • Alía R. García
    • Kranjčević M.
    • Cecchetto M.
    • Söderström D.
    • Mandal A. Raj
    • Gascon J.
    • Trummer J.
    • Vincke H.
    • Alessi A.
    • Cavani O.
    • Constantino A.
    • Lerner G.
    • Sostero L.
    • Girard S.
    • Ferrari M.
    IEEE Transactions on Nuclear Science, Institute of Electrical and Electronics Engineers, 2025, 72 (8), pp.2570-2577. This work presents a comprehensive study of dose rate effects on Ag-doped metaphosphate glass radiophotoluminescence (RPL) dosimeters for doses ranging between 1 Gy and 100 MGy. Data from multiple irradiation campaigns with diverse radiation fields, such as 60Co gamma radiation, X-rays with energy spectrum up to 100 keV, monoenergetic electron beams, and mixed fields offer valuable insights for accurate dosimetry in high-radiation environments. Dose rates ranging over eight decades, from 0.1 kGy/h to 18 MGy/h, are experimentally tested. Low dose rate effects can be observed at low doses; however, for doses higher than 100 kGy, both overestimation and underestimation can occur depending on the dose rate. (10.1109/TNS.2025.3549949)
    DOI : 10.1109/TNS.2025.3549949
  • Thermal Hall conductivity in the strongest cuprate superconductor: Estimate of the mean free path in the trilayer cuprate HgBa2Ca2Cu3O8+δ
    • Altangerel Munkhtuguldur
    • Barthélemy Quentin
    • Lefrançois Étienne
    • Baglo Jordan
    • Mezidi Manel
    • Grissonnanche Gaël
    • Vallipuram Ashvini
    • Campillo Emma
    • Forget Anne
    • Colson Dorothée
    • Liang Ruixing
    • Bonn D.
    • Hardy W.
    • Proust Cyril
    • Taillefer Louis
    Physical Review B, American Physical Society, 2025, 112 (1), pp.014522. (10.1103/1gp5-h875)
    DOI : 10.1103/1gp5-h875
  • Design principles for density functionals using a linear expansion
    • Aouina Ayoub
    • Gatti Matteo
    • Reining Lucia
    npj Computational Materials, Springer Nature, 2025, 11, pp.242. Density Functional Theory is one of the most widely used theoretical approaches for the calculation of properties of materials, but the systematic development of new functionals with controllable accuracy is an ongoing challenge. We propose to use perturbation theory around the homogeneous electron gas in a way that is optimized using physical insight, and to combine it with the recently developed connector approach in order to satisfy an exact limit. In this way, we develop an explicit non-local density functional for the Kohn-Sham exchange correlation potential. First results for the self-consistently calculated charge density and potential for three prototype materials demonstrate which accuracy can be reached for the charge density, confirm the systematicity of the approach, and suggest directions for further improvement. (10.1038/s41524-025-01712-4)
    DOI : 10.1038/s41524-025-01712-4
  • Reactivity of Constitution vs. Crystallization Water Under Irradiation: Insights from Tobermorites
    • Herin Thibaut
    • Alessi Antonino
    • Charpentier Thibault
    • Poyet Stéphane
    • Bouniol Pascal
    • Le Caër Sophie
    International Journal of Hydrogen Energy, Elsevier, 2025, 149, pp.150042. Understanding radiolytic H<sub>2</sub> production in irradiated cement is crucial for nuclear waste safety, yet the role of solid cement phases remains unclear. This study examines the behavior of model minerals -tobermorite 11 Å (Ca<sub>5</sub>Si<sub>6</sub>O<sub>17</sub>.5H<sub>2</sub>O) and tobermorite 9 Å (Ca<sub>5</sub>Si<sub>6</sub>O<sub>16</sub>(OH)<sub>2</sub>)-under electron irradiation. When fully dried, these minerals retain only crystallization water or structural hydroxyl groups, respectively. The results reveal that while crystallization water decomposes under irradiation, it does not lead to H<sub>2</sub> formation, as hydrogen atoms react with radiation-induced defects to form SiO-H bonds. In contrast, tobermorite 9 Å produces H<sub>2</sub> only when surface SiO-H bonds are present, indicating that radiolytic dihydrogen arises from surface bond breakage, while the cleavage of the bonds in the material does not ultimately lead to H<sub>2</sub> production. These findings enhance our understanding of irradiation effects on cementitious materials, aiding in the assessment of their long-term stability in nuclear waste storage. (10.1016/j.ijhydene.2025.150042)
    DOI : 10.1016/j.ijhydene.2025.150042
  • 1D nanoporous membrane boosts the ionic conductivity of electrolytes.
    • Berrod Quentin
    • Zanotti J.-M.
    • Judeinstein Patrick
    • Pinchart Camille
    • Modesto Nino
    • Gigmes Didier
    • Phan T. N. Trang
    • Lairez Didier
    • Ramos Raphael
    • Coasne Benoit
    , 2025.
  • Unconventional solitonic high-temperature superfluorescence from perovskites
    • Biliroglu Melike
    • Türe Mustafa
    • Ghita Antonia
    • Kotyrov Myratgeldi
    • Qin Xixi
    • Seyitliyev Dovletgeldi
    • Phonthiptokun Natchanun
    • Abdelsamei Malek
    • Chai Jingshan
    • Su Rui
    • Herath Uthpala
    • Swan Anna
    • Temnov Vasily
    • Blum Volker
    • So Franky
    • Gundogdu Kenan
    Nature, Nature Publishing Group, 2025, 642 (8066), pp.71-77. Fast thermal dephasing limits macroscopic quantum phenomena to cryogenic conditions1,2,3,4 and hinders their use at ambient temperatures5,6. For electronic excitations in condensed media, dephasing is mediated by thermal lattice motion1,7,8. Therefore, taming the lattice influence is essential for creating collective electronic quantum states at high temperatures. Although there are occasional reports of high-Tc quantum effects across different platforms, it is unclear which lattice characteristics and electron–lattice interactions lead to macroscopically coherent electronic states in solids9. Here we studied intensity fluctuations in the macroscopic polarization during the emergence of superfluorescence in a lead halide perovskite10 and showed that spontaneously synchronized polaronic lattice oscillations accompany collective electronic dipole emission. We further developed an effective field model and theoretically confirmed that exciton–lattice interactions lead to a new electronically and structurally entangled coherent extended solitonic state beyond a critical polaron density. The analysis shows a phase transition with two processes happening in tandem: incoherent disordered polaronic lattice deformations establish an order, while macroscopic quantum coherence among excitons simultaneously emerges. Recombination of excitons in this state culminates in superfluorescence at high temperatures. Our study establishes fundamental connections between the transient superfluorescence process observed after the impulsive excitation of perovskites and general equilibrium phase transitions achieved by thermal cooling. By identifying various electron–lattice interactions in the perovskite structure and their respective role in creating collectively coherent electronic effects in solids, our work provides unprecedented insight into the design and development of new materials that exhibit high-temperature macroscopic quantum phenomena. (10.1038/s41586-025-09030-x)
    DOI : 10.1038/s41586-025-09030-x
  • Enhanced Electromagnetic Wave Absorption in Mapbi<sub>3</sub> Hybrid Perovskite Through a Defect‐Tunable Green Synthesis
    • Cai Yihui
    • Bégin Dominique
    • Lefevre Christophe
    • Sidhoum Charles
    • Elkaïm Erik
    • Boulet Pascal
    • Desgardin Pierre
    • Barthe Marie-France
    • Helm Ricardo
    • Egger Werner
    • Butterling Maik
    • Wagner Andreas
    • Papaefthimiou Vasiliki
    • Zafeiratos Spiros
    • Cianferani Damien
    • Mager Loic
    • Ersen Ovidiu
    • Corbel Catherine
    • Sanchez Clément
    • Bégin-Colin Sylvie
    Small Structures, Wiley, 2025, 6 (9), pp.2500066. Defect engineering and structure‐property relationship understanding in methylammonium lead iodide (MAPI) hybrid perovskites (HPs) attract significant scientific interest, as synthesis‐related defects may strongly influence intrinsic properties. We have explored a green solvent‐free synthesis—mechanosynthesis—leading to large quantities of MAPI powder with tuneable defect density suitable to study MAPI as an electromagnetic wave absorbing (EMWA) material. A dielectric loss enhancement was revealed at 11.4 GHz (X‐band) for 4 h‐ground MAPI powders (MAPI4h), compared to 30 min‐ground powders (MAPI30) when the particle size was &lt;20 μm. MAPI powders display a fractal microstructure with agglomerates of clusters of (nano)grains (≈80 nm for MAPI4h), consisting further of oriented smaller nanograin (5–10 nm) clusters. A strong reabsorption in smaller particles was evidenced due to a surface‐defective layer. MAPI4h was shown to display a more surface‐defective layer with a higher defect density gradient from surface to (nano)grains core and unique open defects different from those in solution‐processed MAPI. These vacancy‐type surface defects would enhance dipole polarization by stabilizing methylammonium dipoles, thereby increasing permittivity. The improved dispersion of MAPI particles (&lt;20 μm) in polymeric matrixes enhanced the surface effects and effective interactions with electromagnetic waves. This study demonstrated the potential of this green synthesis for producing large amount of HPs and tuning defects, opening new avenues for HPs EMWA application. (10.1002/sstr.202500066)
    DOI : 10.1002/sstr.202500066
  • How exotic oxide glasses can provide solutions for integrated optics ?
    • Cardinal Thierry
    • Alassani Fouad
    • Zaiter Rayan
    • Fargues Alexandre
    • Jubera Veronique
    • Ollier Nadège
    • Lancry Matthieu
    • Vallée Réal
    • Petit Yannick
    • Canioni Lionel
    , 2025.
  • Phonon dynamics investigation of phase transitions: the case of CDW 1T-TaS2
    • Péronne Emmanuel
    • Lample Pierrick
    • Weis Mateusz
    • Cario Laurent
    • Perfetti Luca
    • Boschetto Davide
    , 2025. The layered dichalcogenide 1T-TaS2 crystal represents a paradigm in the study of quantum materials, particularly in the context of charge density wave (CDW) phenomena1,2. Renowned for its series of CDW transitions, including incommensurate (IC), nearly commensurate (NC), and commensurate (C) phases, 1T-TaS2 exhibits a rich landscape of electron-lattice interactions and phase behaviors3,4. In the C-phase, typically below 174 K, the Ta atoms arrange a regular pattern, forming David's star configuration, which is repeated periodically to cover the entire crystal, creating a super-lattice5,6. Above 215 K, the TaS2 lattice reaches the NC phase where some of the David stars disappear, breaking, at long range, the super-lattice properties. While some regions keep David's star super-lattice structure, other regions loose the super-lattice character which leads to a lattice incommensurability. Such changes in the TaS2 induce a shrinkage of the band gap at the Fermi surface leading to more metallic behavior. Here, we use coherent phonon spectroscopy to investigate two coherent phonon modes in the 1T-TaS2 bulk crystal at 2.05 and 2.30THz, respectively, as a function of the temperature across the phase transition along the hysteresis loop and as a function of the pump fluence. In particular, we observed that the amplitude of the two coherent phonon modes undergoes a hysteresis loops at the same temperature of the electrical resistivity when warming up and cooling down the crystal. We also observed that the low frequency mode is blue-shifted after several picoseconds for high pump fluence, a time scale which can be attributed to the photo-induced phase transition into the so called hidden phase or H-phase7,8. Both comparisons, between the phonons and the resistivity behavior and between the frequency jump and H phase prediction, give insight into the role of lattice vibrations and electron-phonon coupling during this phase transition.