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Mikhail I. Katsnelson

Publications and source records attributed to Mikhail I. Katsnelson.

At least 19 recordsLinked to original sources

Breakdown of Charge-Conjugation Symmetry of Disclinations in 2D Crystals

Disclinations are elementary topological defects in two-dimensional (2D) crystalline membranes, yet their elastic properties remain largely unexplored. Using atomistic simulations, we address the energetics, morphology, and interactions of disclinations in free-standing graphene, a prototypical 2D crystal. We find that while disclinations with positive topological charges follow an expected behavior, negative disclinations exhibit sublinear energy scaling with charge as well as equilibrium shape that deviates sharply from the conventional saddle ansatz. This breakdown of charge-conjugation symmetry leads to qualitatively distinct interactions: positive disclinations repel, whereas negative disclinations display a robust long-range attraction. These trends are shown to be further amplified by self-adhesion in folded membranes. Our results uncover a fundamentally different energetic landscape for negative curvature defects and provide a basis for understanding the stability, self-folding behavior, and defect-driven morphology of graphene and other 2D membranes.

cond-mat.mes-hall↗

Directing Open-Ended Evolution in Artificial Life via Multi-Scale Path Divergence

Open-ended evolution (OEE) in artificial life is typically driven by uninterpretable, black-box neural-network complexity metrics, leaving life-like systems disconnected from physical theories of complexity. We introduce MSPD (Multi-Scale Path Divergence, denoted $D_P$), a renormalization-group-inspired scalar that quantifies how the heterogeneity of a system's local transition laws is organized across temporal and spatial scales. MSPD is defined at the population level as a functional of the realised trajectory and is computed as a windowed finite-resolution estimator, with consistency between the two stated as a proposition. The metric is an explicit formula and plays a dual role: as a gradient-free fitness function and as a post-hoc analytical lens on any simulation that exposes local transition laws. On a Flow-Lenia substrate we establish three claims. (C1) Under fixed-context replay of the exact pathwise objective, MSPD-optimized parameters score higher than matched random parameters. (C2) Along optimized trajectories, states whose local transition laws are more heterogeneous yield larger future divergence than matched, less-heterogeneous states under exact-state stochastic continuations, so the metric tracks intrinsic dynamics rather than injected noise. (C5) Higher MSPD corresponds to stronger scale-dependent frustration --- larger differences between the dynamics expressed at different spatial extents --- linking MSPD to the frustration criterion of biological complexity in the sense of Vanchurin et al. All three transfer to Life-like cellular automata and Particle Life++, indicating that MSPD is not specific to a single substrate. A single explicit formula thus both \emph{directs} open-ended evolution and provides a principled bridge to the physics of complexity that black-box drivers do not.

cs.NE↗

Magnetothermopower and particle-hole symmetry in a cuprate strange metal

Here, we report magnetothermopower measurements on overdoped (Bi,Pb)2(Sr,La)2CuO6+delta (Bi2201) single crystals in magnetic fields up to 35 T. Whereas the temperature dependence of the zero-field Seebeck coefficient S(T) can be captured using Boltzmann transport theory, the field-dependent response S(H) cannot. Instead, the magnetothermopower contains a large additional contribution whose field and temperature dependence is consistent with the presence of short-range superconducting order well above Tc. Combined with earlier Hall and magnetoresistance results, these data imply that the overdoped cuprate strange metal contains two transport sectors with distinct particle-hole symmetry: a conventional particle-hole-asymmetric Fermi-liquid (FL) contribution governing the Hall effect and the zero-field thermopower, and a nearly particle-hole-symmetric sector dominating the anomalous longitudinal magnetotransport. We formulate a phenomenological real-space model in which disconnected FL islands are embedded in a compensated Dirac liquid of phase-incoherent d-wave Bogoliubov quasiparticles. This picture reconciles conventional zero-field transport with anomalous magnetothermopower and magnetoresistance and offers a concrete framework for thinking about strange metallicity in overdoped cuprates.

cond-mat.supr-con↗

Can Stationary Distributions of Scale-Invariant Neural Networks Be Described by the Thermodynamics of an Ideal Gas?

Understanding the training dynamics of deep neural networks remains a major open problem, with physics-inspired approaches offering promising insights. Building on this perspective, we develop a thermodynamic framework to describe the stationary distributions of stochastic gradient descent (SGD) with weight decay for scale-invariant neural networks, a setting that both reflects practical architectures with normalization layers and permits theoretical analysis. We establish analogies between training hyperparameters (e.g., learning rate, weight decay) and thermodynamic variables such as temperature, pressure, and volume. Starting with a simplified isotropic noise model, we uncover a close correspondence between SGD dynamics and ideal gas behavior, validated through theory and simulation. Extending to training of neural networks, we show that key predictions of the framework, including the behavior of stationary entropy, align closely with experimental observations. This framework provides a principled foundation for interpreting training dynamics and may guide future work on hyperparameter tuning and the design of learning rate schedulers.

cs.LG↗

Extended Hubbard model on fractals: d-Wave superconductivity and competing pairing channels

Fractal structures such as the Sierpiński gasket have been predicted to enhance the critical temperature of s-wave superconductivity compared to regular crystals while maintaining macroscopic phase coherence of Cooper pairs. Here we extend this analysis to order parameters with non-trivial symmetry by studying the extended Hubbard model with nearest-neighbor attraction on fractal lattices. Using Bogoliubov-de Gennes mean-field theory, we find that the Sierpiński carpet dramatically alters the competition between pairing channels: the predominant d-wave superconducting dome at half filling of the square lattice becomes unstable for the carpet, while at high and low fillings extended s-wave pairing gets strongly enhanced. We attribute this to geometric frustration of sign-changing order parameters by the fractal boundary structure. On the triangular Sierpiński gasket, hybrid s+d+id states show critical temperature enhancement comparable to that previously observed for pure s-wave pairing. Our results demonstrate that fractal geometry acts as a selective filter for pairing symmetries, with the compatibility between order parameter structure and lattice topology determining which channels are stabilized or suppressed.

cond-mat.supr-con↗

Comment on the "Electric Power Generation from Earth's Rotation through its Own Magnetic Field"

The suggestion made by C. F. Chyba and K. P. Hand about electric power generation from Earth's rotation through its own magnetic field is intriguing [1, 2]. Due to the importance of the subject, we have re-analyzed the theoretical arguments and derivations leading to their conclusion, by paying special attention to several issues possibly neglected before. The model they consider is a magnetic cylindrical shell moving with velocity $\mathbf{v}$ in the $y$ direction at a right angle to the direction of the Earth's magnetic field $\mathbf{B}_\infty$. First we analyze the electromagnetic boundary conditions when the shell is moving with a constant velocity $\mathbf{v}$, as this point, although of importance, has not been taken care of in [1, 2]. Indeed, this procedure leads us to differences in the values of electromagnetic fields when compared with the expressions given in the cited references. Second and as a result, we find that the mechanical force created by the moving shell becomes different from the one derived in [1, 2]. Obviously, the expression for the amount of electric power generation from Earth's rotation will also be different from the previously obtained one. The latter is important for evaluating the amount of produced power, maximizing it by choosing the parameters of the shell, and for the comparison with experimental findings.

physics.class-ph↗

Halogen Chains with One-Dimensional Semi-Metallic Electronic Structure and Peierls Physics in Polymorphs of Na4X5 (X = I, Br, Cl) Compounds

Since the pioneering works of Peierls, one-dimensional materials have attracted great attention. Still, the synthesis of truly monoatomic chains remains elusive. In this study, we explore a novel path of experimental synthesis of monoatomic one-dimensional chains by their chemical stabilization in ionic compounds. We demonstrate that in synthesized at high pressure sodium halides Na4X5 (X = I, Br, Cl) with hP18 Ga4Ti5-type structures, transfer of valence electrons from cations to anions leads to the formation of halogen chains connected with other atoms only by ionic interaction and having one-dimensional electronic structure. The Peierls physics in the systems is confirmed by theoretical calculations, newly synthesized incommensurately modulated i-hP18-Na4X5 (X = I, Br, Cl) compounds, as well as by the discovered hP36 phases of Na4Cl5 and Na4Br5.

cond-mat.mtrl-sci↗

Emergence of non-ergodic multifractal quantum states in geometrical fractals

Eigenstate multifractality, a hallmark of non-interacting disordered metals, which may also be observed in many-body localized states, is characterized by anomalous slow dynamics and appears relevant for many areas of quantum physics, from measurement-driven systems to superconductivity. We propose a novel approach to achieve non-ergodic multifractal states (NEMs) without disorder by iteratively introducing defects into a crystal lattice, reshaping it from a plain structure into a fractal geometry. By comprehensive analysis of the Sierpiński gasket case, we find robust evidence of the emergence of NEMs that go beyond the conventional classification of quantum states and designate new pathways for quantum transport studies. We discuss potential experimental signatures of these states.

cond-mat.dis-nn↗

From strong to weak correlations in breathing-mode kagome van der Waals materials: Nb$_3$(F,Cl,Br,I)$_8$ as a robust and versatile platform for many-body engineering

By combining ab initio downfolding with cluster dynamical mean-field theory, we study the degree of correlations in monolayer, bilayer and bulk breathing-mode kagome van der Waals materials Nb$_3$(F,Cl,Br,I)$_8$. Our new material-specific many-body model library shows that in low-temperature bulk structures the Coulomb correlation strength steadily increases from I to F, allowing us to identify Nb$_3$I$_8$ as a weakly correlated insulator, Nb$_3$Br$_8$ and Nb$_3$Cl$_8$ as strongly correlated insulators, and Nb$_3$F$_8$ as a prototypical bulk Mott-insulator. Angle-resolved photoemission spectroscopy measurements comparing Nb$_3$Br$_8$ and Nb$_3$I$_8$ allow us to experimentally confirm these findings by revealing spectroscopic footprints of the degree of correlation. Our calculations uncover how the thickness and the stacking affect the degree of correlations and predict that the entire material family can be tuned into correlated charge-transfer or Mott-insulating phases upon doping. Our magnetic property analysis based on our model parameter library additionally confirms that inter-layer magnetic interactions drive the lattice phase transition to the low-temperature structures. The accompanying bilayer hybridization through inter-layer dimerization yields magnetic singlet-like ground states in the Cl, Br, and I compounds. We further prove that all low-temperature compounds are dynamically stable and that electron-phonon coupling to the low-energy subspace is suppressed. Our findings establish Nb$_3$X$_8$ as a robust, versatile, and tunable class for van der Waals-based Coulomb and Mott engineering with a rich phase diagram and allow us to speculate on the symmetry-breaking effects necessary for the recently observed Josephson diode effect in NbSe$_2$/Nb$_3$Br$_8$/NbSe$_2$ heterostructures.

cond-mat.str-el↗

Learning complexity of many-body quantum sign structures through the lens of Boolean Fourier analysis

We study sign structures of the ground states of spin-$1/2$ magnetic systems using the methods of Boolean Fourier analysis. Previously it was shown that the sign structures of frustrated systems are of complex nature: specifically, neural networks of popular architectures lack the generalization ability necessary to effectively reconstruct sign structures in supervised learning settings. This is believed to be an obstacle for applications of neural quantum states to frustrated systems. In the present work, we develop an alternative language for the analysis of sign structures based on representing them as polynomial functions defined on the Boolean hypercube - an approach called Boolean Fourier analysis. We discuss the relations between the properties of the Boolean Fourier series and the learning complexity of sign structures, and demonstrate that such polynomials can potentially serve as variational ansätze for the complex sign structures that dramatically outperform neural networks in terms of generalization ability. While ansätze of this type cannot yet be directly used in the context of variational optimization, they indicate that the complexity of sign structures is not an insurmountable curse, and can potentially be learned with better designed NQS architectures. Finally, we show how augmenting data with Boolean functions can aid sign prediction by neural networks.

cond-mat.dis-nn↗

Enhancing Plasmonic Superconductivity in Layered Materials via Dynamical Coulomb Engineering

Conventional Coulomb engineering, through controlled manipulation of the environment, offers an effective route to tune the correlation properties of atomically thin van der Waals materials via static screening. Here we present tunable dynamical screening as a method for precisely tailoring bosonic modes to optimize many-body properties. We show that ``bosonic engineering'' of plasmon modes can be used to enhance plasmon-induced superconducting critical temperatures of layered superconductors in metallic environments by up to an order of magnitude, due to the formation of interlayer hybridized plasmon modes with enhanced superconducting pairing strength. We determine optimal properties of the screening environment to maximize critical temperatures. We show how bosonic engineering can aid the search for experimental verification of plasmon mediated superconductivity.

cond-mat.supr-con↗

Emergence of global receptive fields capturing multipartite quantum correlations

In quantum physics, even simple data with a well-defined structure at the wave function level can be characterized by extremely complex correlations between its constituent elements. The inherent non-locality of the quantum correlations generally prevents one from providing their simple and transparent interpretation, which also remains a challenging problem for advanced classical techniques that approximate quantum states with neural networks. Here we show that monitoring the neural network weight space while learning quantum statistics from measurements allows to develop physical intuition about complex multipartite patterns and thus helps to construct more effective classical representations of the wave functions. Particularly, we observe the formation of distinct global convolutional structures, receptive fields in the hidden layer of the Restricted Boltzmann Machine (RBM) within the neural quantum tomography of the highly-entangled Dicke states. On this basis we propose an exact two-parameter classical representation not only for a specific quantum wave function, but for the whole family of the N-qubit Dicke states of different entanglement. Our findings suggest a fresh look at constructing convolutional neural networks for processing data with non-local patterns and pave the way for developing exact learning-based representations of entangled quantum states.

quant-ph↗

Quantitative theory of magnetic properties of elemental praseodymium

Elemental Pr metal crystallizes in the double hexagonal close packed (dhcp) structure and is unique among rare-earth elements in featuring a localized partially filled 4f shell without ordered magnetism. Experimental evidence attributes this absence of magnetism to a singlet crystal-field (CF) ground state of the Pr 4f$^2$ configuration, which is energetically well isolated from excited magnetic doublets. Here, we construct a realistic effective magnetic Hamiltonian for dhcp Pr, by combining density-functional theory with dynamical mean-field theory, in the quasiatomic Hubbard-I approximation. Our calculations fully determine the CF potential and predict singlet CF ground states at both inequivalent sites of the dhcp lattice. The intersite exchange interactions, obtained from the magnetic force theorem, are found to be insufficient to close the CF gap to the magnetic doublets. Hence, ab-initio theory is demonstrated to explain the unusual, non-magnetic state of elemental Pr. Extending this analysis to the (0001) surface of Pr, we find that the singlet ground state remains robust preventing conventional magnetic orders. Nevertheless, the gap between the ground state and the lowest excited singlet is significantly reduced at the surface, opening the possibility for exotic two-dimensional multipolar orders to emerge within this two-singlet manifold.

cond-mat.str-el↗

Fröhlich versus Bose-Einstein Condensation in Pumped Bosonic Systems

Magnon-condensation, which emerges in pumped bosonic systems at room temperature, continues to garner great interest for its long-lived coherence. While traditionally formulated in terms of Bose-Einstein condensation, which typically occurs at ultra-low temperatures, it could potentially also be explained by Fröhlich-condensation, a hypothesis of Bose-Einstein-like condensation in living systems at ambient temperatures. This prompts general questions relating to fundamental differences between coherence phenomena in open and isolated quantum systems. To that end, we introduce a simple model of bosonic condensation in an open quantum system (OQS) formulation, wherein bosons dissipatively interact with an oscillator (phonon) bath. Our derived equations of motion for expected boson occupations turns out to be similar in form to the rate equations governing Fröhlich-condensation. Provided that specific system parameters result in correlations that amplify or diminish the condensation effects, we thereby posit that our treatment offers a better description of high-temperature condensation compared to traditional formulations obtained using equilibrium thermodynamics. By comparing our OQS derivation with the original uncorrelated and previous semi-classical rate equations, we furthermore highlight how both classical anti-correlations and quantum correlations alter the bosonic occupation distribution.

cond-mat.quant-gas↗

Strong enhancement of superconductivity on finitely ramified fractal lattices

Using the Sierpinski gasket (triangle) and carpet (square) lattices as examples, we theoretically study the properties of fractal superconductors. For that, we focus on the phenomenon of $s$-wave superconductivity in the Hubbard model with attractive on-site potential and employ the Bogoliubov-de Gennes approach and the theory of superfluid stiffness. For the case of the Sierpinski gasket, we demonstrate that fractal geometry of the underlying crystalline lattice can be strongly beneficial for superconductivity, not only leading to a considerable increase of the critical temperature $T_c$ as compared to the regular triangular lattice but also supporting macroscopic phase coherence of the Cooper pairs. In contrast, the Sierpinski carpet geometry does not lead to pronounced effects, and we find no substantial difference as compared with the regular square lattice. We conjecture that the qualitative difference between these cases is caused by different ramification properties of the fractals.

cond-mat.supr-con↗

Optical properties, plasmons, and orbital Skyrme textures in twisted TMDs

In the long-wavelength limit, Bloch-band Berry curvature has no effect on the bulk plasmons of a two-dimensional electron system. In this Letter we show instead that bulk plasmons are a probe of real-space topology. In particular, we focus on orbital Skyrme textures in twisted transition metal dichalcogenides, presenting detailed semiclassical and quantum mechanical calculations of the optical conductivity and plasmon spectrum of twisted ${\rm MoTe}_2$.

cond-mat.mes-hall↗

Anisotropic effects in two-dimensional materials

Among a huge variety of known two-dimensional materials, some of them have anisotropic crystal structures; examples include so different systems as a few-layer black phoshphorus (phosphorene), beryllium nitride BeN$_4$, van der Waals magnet CrSBr, rhenium dichalgogenides ReX$_2$. As a consequence, their optical and electronic properties turn out to be highly anisotropic as well. In some cases, the anisotropy results not just in a smooth renormalization of observable properties in comparison with the isotropic case but in the appearance of dramatically new physics. The examples are hyperbolic plasmons and excitons, strongly anisotropic ordering of adatoms at the surface of two-dimensional or van der Waals materials, essential change of transport and superconducting properties. Here, we present a systematic review of electronic structure, transport and optical properties of several representative groups of anisotropic two-dimensional materials including semiconductors, anisotropic Dirac and semi-Dirac materials, as well as superconductors.

cond-mat.mtrl-sci↗

Phonon-induced renormalization of exchange interactions in metallic two-dimensional magnets

The presence of spin-polarized charge carriers in metallic magnets provides a mechanism for spin-lattice interactions mediated by electron-phonon coupling. Here, we present a theory of this mechanism used to estimate its effect on the exchange interactions in 2D magnets. Starting from a square lattice model at half filling, we show that the presence of electron-phonon coupling with equilibrium phonon distribution leads to a notable suppression of exchange interactions with temperature. We then apply our approach to the prototypical 2D metallic ferromagnet, Fe$_3$GeTe$_2$, with moderate electron-phonon coupling. We find that the exchange interactions undergo a renormalization, leading to a softening of the magnon modes, and suppression of the Curie temperature by $\sim$10\%. We expect that this effect can be further enhanced in systems with strong electron-phonon coupling, as well as for non-equilibrium distribution of phonons induced by strong laser fields or charge currents.

cond-mat.mtrl-sci↗