Daily Papers

Capturing static and dynamic electron correlation simultaneously at manageable computational cost remains a key challenge in electronic structure theory. Motivated by the recurring role of effective temperature in self-consistent field methods we extend the adiabatic connection mechanism from density functional theory to include a temperature dimension. This gives rise to thermally enhanced hybrid functionals, in which static correlation is captured via fractional occupations generated by an effective "correlation temperature" within thermal Hartree-Fock, while dynamic correlation is described by established density functional approximations. The framework formally unifies information-density matrix functional theory (i-DMFT) and thermally-assisted-occupation (TAO-)DFT as special cases, clarifying their theoretical basis and the respective prescriptions for the temperature parameter. We assess the performance of several thermally enhanced hybrids for different cases where i-DMFT was previously shown to fail. Furthermore, we discuss and test different schemes for determining the correlation temperature and investigate the accuracy of different such choices for a benchmark set derived from biphenyl. The results help to clarify the achievable balance of accuracy, generality, and efficiency, establishing thermally enhanced hybrids as a systematic route toward low-cost treatment of both correlation types.

Neural quantum states (NQS) have emerged as a powerful tool for approximating quantum wavefunctions using deep learning. While these models achieve remarkable accuracy, understanding how they encode physical information remains an open challenge. In this work, we introduce adiabatic fine-tuning, a scheme that trains NQS across a phase diagram, leading to strongly correlated weight representations across different models. This correlation in weight space enables the detection of phase transitions in quantum systems by analyzing the trained network weights alone. We validate our approach on the transverse field Ising model and the J1-J2 Heisenberg model, demonstrating that phase transitions manifest as distinct structures in weight space. Our results establish a connection between physical phase transitions and the geometry of neural network parameters, opening new directions for the interpretability of machine learning models in physics.

All current formulations of thermodynamics invoke some form of coarse-graining or ensembles as the supposed link between their own laws and the microscopic laws of motion. They deal only with ensemble-averages, expectation values, macroscopic limits, infinite heat baths, etc., not with the details of physical variables of individual microscopic systems. They are consistent with the laws of motion for finite systems only in certain approximations, which improve with increasing scale, given various assumptions about initial conditions which are neither specified precisely nor even thought to hold exactly in nature. Here I propose a new formulation of the zeroth, first and second laws, improving upon the axiomatic approach to thermodynamics (Carath\'eodory, 1909; Lieb & Yngvason, 1999), via the principles of the recently proposed constructor theory. Specifically, I provide a non-approximative, scale-independent formulation of 'adiabatic accessibility'; this in turn provides a non-approximative, scale-independent distinction between work and heat and reveals an unexpected connection between information theory and the first law of thermodynamics (not just the second). It also achieves the long-sought unification of the axiomatic approach with Kelvin's.

We provide a theoretical analysis for a recently demonstrated cooling method. Two-level particles undergo successive adiabatic transfers upon interaction with counter-propagating laser beams that are repeatedly swept over the transition frequency. We show that particles with narrow linewidth transitions can be cooled to near the recoil limit. This cooling mechanism has a reduced reliance on spontaneous emission compared to Doppler cooling, and hence shows promise for application to systems lacking closed cycling transitions, such as molecules.

We verify a recent prediction (Eq. 3.50 in G. L. Eyink, Phys. Rev. X 11, 031054 (2021)) for the drag on an object moving through a fluid. In this prediction the velocity field is decomposed into a nonvortical (potential) and vortical contribution, and so is the associated drag force. In the Josephson-Anderson relation the vortical contribution of the drag force follows from the flux of vorticity traversing the streamlines of the corresponding potential flow. The potential component is directly determined by the plate acceleration and its added mass. The Josephson-Anderson relation is derived from the quantum description of superfluids, but remarkably applies to the classical fluid in our experiment. In our experiment a flat plate is accelerated through water using a robotic arm. This geometry is simple enough to allow analytic potential flow streamlines. The monitored plate position shows an oscillatory component of the acceleration, which adds an additional test of the Josephson-Anderson relation. The instantaneous velocity field is measured using particle image velocimetry. It enables us to evaluate Eq. 3.50 from [1] and compare its prediction to the measured drag force. We find excellent agreement, and, most remarkably find that the added mass contribution to the drag force still stands out after the flow has turned vortical. We finally comment on the requirements on the experimental techniques for evaluating the Josephson-Anderson relation.

The Mechanistic Interpretability (MI) program has mapped the Transformer as a precise computational graph. We extend this graph with a conservation law and time-varying AC dynamics, viewing it as a physical circuit. We introduce Momentum Attention, a symplectic augmentation embedding physical priors via the kinematic difference operator p_t = q_t - q_{t-1}, implementing the symplectic shear q_t = q_t + γp_t on queries and keys. We identify a fundamental Symplectic-Filter Duality: the physical shear is mathematically equivalent to a High-Pass Filter. This duality is our cornerstone contribution -- by injecting kinematic momentum, we sidestep the topological depth constraint (L geq 2) for induction head formation. While standard architectures require two layers for induction from static positions, our extension grants direct access to velocity, enabling Single-Layer Induction and Spectral Forensics via Bode Plots. We formalize an Orthogonality Theorem proving that DC (semantic) and AC (mechanistic) signals segregate into orthogonal frequency bands when Low-Pass RoPE interacts with High-Pass Momentum. Validated through 5,100+ controlled experiments (documented in Supplementary Appendices A--R and 27 Jupyter notebooks), our 125M Momentum model exceeds expectations on induction-heavy tasks while tracking a 350M baseline within sim2.9% validation loss. Dedicated associative recall experiments reveal a scaling law γ^* = 4.17 times N^{-0.74} establishing momentum-depth fungibility. We offer this framework as a complementary analytical toolkit connecting Generative AI, Hamiltonian Physics, and Signal Processing.

An influential conjecture by Witten states that there is an instanton Floer homology of four-manifolds with corners that in certain situations is isomorphic to Khovanov homology of a given knot K. The Floer chain complex is generated by Nahm pole solutions of the Kapustin-Witten equations on R^3 times R^+_y with an additional monopole-like singular behaviour along the knot K inside the three-dimensional boundary at y=0. The Floer differential is given by counting solutions of the Haydys-Witten equations that interpolate between Kapustin-Witten solutions along an additional flow direction R_s. This article investigates solutions of a decoupled version of the Kapustin-Witten and Haydys-Witten equations on R_s times R^3 times R^+_y, which in contrast to the full equations exhibit a Hermitian Yang-Mills structure and can be viewed as a lift of the extended Bogomolny equations (EBE) from three to five dimensions. Inspired by Gaiotto-Witten's approach of adiabatically braiding EBE-solutions to obtain generators of the Floer homology, we propose that there is an equivalence between adiabatic solutions of the decoupled Haydys-Witten equations and non-vertical paths in the moduli space of EBE-solutions fibered over the space of monopole positions. Moreover, we argue that the Grothendieck-Springer resolution of the Lie algebra of the gauge group provides a finite-dimensional model of this moduli space of monopole solutions. These considerations suggest an intriguing similarity between Haydys-Witten instanton Floer homology and symplectic Khovanov homology and provide a novel approach towards a proof of Witten's gauge-theoretic interpretations of Khovanov homology.

We apply the Nakajima-Zwanzig approach to open quantum systems to study steady-state transport across generic multi-level junctions coupled to bosonic or fermionic reservoirs. The method allows for a unified diagrammatic formulation in Liouville space, with diagrams being classified according to an expansion in the coupling strength between the reservoirs and the junction. Analytical, approximate expressions are provided up to fourth order for the steady-state boson transport that generalize to multi-level systems the known results for the low-temperature thermal conductance in the spin-boson model. The formalism is applied to the problem of heat transport in a qubit-resonator junction modeled by the quantum Rabi model. Nontrivial transport features emerge as a result of the interplay between the qubit-oscillator detuning and coupling strength. For quasi-degenerate spectra, nonvanishing steady-state coherences cause a suppression of the thermal conductance.

In quantum mechanics of genus-1 potentials, perturbation theory around the topologically trivial saddle and non-perturbative instanton saddle are constructively related via the P/NP relation. Whether such a relation persists for higher-genus potentials has remained an open problem. In this work, we resolve it using tools from complex algebraic geometry combined with exact WKB. The classical energy conservation relation p^2 = 2(E-V(q)) defines a genus-g Riemann surface X, whose periods are naturally organized by its Jacobian variety J(X) = C^{g}/Λ via the Abel-Jacobi map, and independently by the solution basis of the associated Picard-Fuchs equations. We show that the physically relevant, WKB-active cycles are generally related to the Picard-Fuchs basis by a linear transformation that lies in SL(2g,Z) but not in the symplectic group Sp(2g,Z) once ggeq2, in contrast to the genus-1 case, where the two groups coincide. This mismatch is the obstruction that has made an explicit higher-genus P/NP relation elusive. We show that it can be resolved by passing to a modified Riemann bilinear identity, built from a suitably transformed intersection matrix, which the WKB-active periods do satisfy exactly. The result is an all-orders quantum P/NP relation valid for potentials of arbitrary genus, which we derive explicitly for genus-2 (quintic and sextic) and genus-3 (septic and octic) anharmonic oscillators.

The fundamental trade-off between robustness and tunability is a central challenge in the pursuit of quantum simulation and fault-tolerant quantum computation. In particular, many emerging quantum architectures are designed to achieve high coherence at the expense of having fixed spectra and consequently limited types of controllable interactions. Here, by adiabatically transforming fixed-frequency superconducting circuits into modifiable Floquet qubits, we demonstrate an XXZ Heisenberg interaction with fully adjustable anisotropy. This interaction model is on one hand the basis for many-body quantum simulation of spin systems, and on the other hand the primitive for an expressive quantum gate set. To illustrate the robustness and versatility of our Floquet protocol, we tailor the Heisenberg Hamiltonian and implement two-qubit iSWAP, CZ, and SWAP gates with estimated fidelities of 99.32(3)%, 99.72(2)%, and 98.93(5)%, respectively. In addition, we implement a Heisenberg interaction between higher energy levels and employ it to construct a three-qubit CCZ gate with a fidelity of 96.18(5)%. Importantly, the protocol is applicable to various fixed-frequency high-coherence platforms, thereby unlocking a suite of essential interactions for high-performance quantum information processing. From a broader perspective, our work provides compelling avenues for future exploration of quantum electrodynamics and optimal control using the Floquet framework.