new

Get trending papers in your email inbox!

Subscribe

Daily Papers

byAK and the research community

Nov 11

Qiskit Code Assistant: Training LLMs for generating Quantum Computing Code

Code Large Language Models (Code LLMs) have emerged as powerful tools, revolutionizing the software development landscape by automating the coding process and reducing time and effort required to build applications. This paper focuses on training Code LLMs to specialize in the field of quantum computing. We begin by discussing the unique needs of quantum computing programming, which differ significantly from classical programming approaches or languages. A Code LLM specializing in quantum computing requires a foundational understanding of quantum computing and quantum information theory. However, the scarcity of available quantum code examples and the rapidly evolving field, which necessitates continuous dataset updates, present significant challenges. Moreover, we discuss our work on training Code LLMs to produce high-quality quantum code using the Qiskit library. This work includes an examination of the various aspects of the LLMs used for training and the specific training conditions, as well as the results obtained with our current models. To evaluate our models, we have developed a custom benchmark, similar to HumanEval, which includes a set of tests specifically designed for the field of quantum computing programming using Qiskit. Our findings indicate that our model outperforms existing state-of-the-art models in quantum computing tasks. We also provide examples of code suggestions, comparing our model to other relevant code LLMs. Finally, we introduce a discussion on the potential benefits of Code LLMs for quantum computing computational scientists, researchers, and practitioners. We also explore various features and future work that could be relevant in this context.

  • 8 authors
·
May 29, 2024

Superspace Concentration and Adversarial Robustness in Quantum Algorithms

We study superspace concentration as a quantum resource, formalized through the focus measure F(ho) = λ_max(ho_super) - the largest eigenvalue of the reduced superspace state - which quantifies the capacity of a quantum system to concentrate informational weight into a preferred subspace of an extended degree-of-freedom space. We develop a complete resource-theoretic framework around this measure and validate its properties through GPU-accelerated numerical simulation. Analytic decoherence predictions are confirmed to machine precision (1.11 x 10^{-16}) for superspace dimensions dS in {2,4,8,16,32}. Focus monotonicity holds across 10,000 random states with zero violations under four focus-non-generating channels across six system configurations. Focused quantum states resist coherent unitary attacks with significantly greater resilience than standard fidelity predicts, with focus remaining above 0.9 at attack strength ε = 0.302 versus ε = 0.174 for fidelity. We further demonstrate that the focus measure and the U(dS)-asymmetry measure are operationally distinct: asymmetry remains near zero and provides no robustness signal under coherent and targeted attacks while focus tracks spectral concentration and remains robust until ε > 0.3. The connection between Grover's algorithm and superspace concentration is made explicit via the identity F(|ψ_k><ψ_k|) = P(marked), providing a resource-theoretic interpretation of oracle query complexity. Finally, we provide the first numerical characterization of the focus capacity gap ΔF, identifying a log_2(dS) scaling law confirmed for both product and correlated noise channels.

  • 6 authors
·
Jun 9

Quantum complexity resource in Gaussian boson sampling: Core structure of the semidefinite program

We present a rigorous analysis of the algebraic and geometric structure of the quantum complexity resource of a system of bosonic modes in Gaussian boson sampling. This resource underlies the quantum advantage of the system: its photon-counting statistics require the evaluation of a hafnian of the resource covariance matrix, and that computation is #P-hard. The resource covariance matrix is the solution of a semidefinite program that extracts the minimum-trace physical quantum part of the total covariance matrix; the complementary part is positive semidefinite and can therefore be simulated classically. Earlier work characterized this resource only through the trace of the quantum part, equal to its photon number. We characterize the optimizer itself, as a quantum state and as a geometric object, beyond the scalar given by its trace. We prove that it is a unique pure Gaussian state and construct an explicit oracle map, obeying an algebraic Riccati identity, that reconstructs the resource. We prove that the full problem compresses exactly onto the active symplectic sector that the dual program support generates. The passive-diagonalizable states are solved in closed form, the first explicit solvable class, and the whole program is shown to be equivalent to a minimization over the symplectic group, that is, over the Siegel upper half-space. Together these results establish that the program determines a canonical localized pure Gaussian component of the resource, and they provide the structural foundation for its detailed analysis.

  • 2 authors
·
Jun 28

On the Holographic Geometry of Deterministic Computation

Standard simulations of Turing machines suggest a linear relationship between the temporal duration t of a run and the amount of information that must be stored by known simulations to certify, verify, or regenerate the configuration at time t. For deterministic multitape Turing machines over a fixed finite alphabet, this apparent linear dependence is not intrinsic: any length-t run can be simulated using O(t) work-tape cells via a Height Compression Theorem for succinct computation trees together with an Algebraic Replay Engine. In this paper we recast that construction in geometric and information-theoretic language. We interpret the execution trace as a spacetime DAG of local update events and exhibit a family of recursively defined holographic boundary summaries such that, along the square-root-space simulation, the total description length of all boundary data stored at any time is O(t). Using Kolmogorov complexity, we prove that every internal configuration has constant conditional description complexity given the appropriate boundary summary and time index, establishing that the spacetime bulk carries no additional algorithmic information beyond its boundary. We express this as a one-dimensional computational area law: there exists a simulation in which the information capacity of the active "holographic screen'' needed to generate a spacetime region of volume proportional to t is bounded by O(t). In this precise sense, deterministic computation on a one-dimensional work tape admits a holographic representation, with the bulk history algebraically determined by data residing on a lower-dimensional boundary screen.

  • 1 authors
·
Dec 4, 2025

Physics Is All You Need? A Case Study in Physicist-Supervised AI Development of Scientific Software

Are AI agents tools, co-authors, or researchers? We present a quantified case study (N=1): a physicist supervising an AI coding agent (Claude Code, Sonnet and Opus models) over 12 work days and 57 sessions to build CLAX-PT, a differentiable one-loop perturbation theory module in JAX. We documented and classified 15 supervision events by intervention level. The agent resolved ten autonomously by iterating against oracle tests. Two more by the physicist's domain knowledge. The three it could not -- all evaded oracle detection -- share a common property: the agent treated symptom reduction as root-cause resolution. It spent 33 of the 57 sessions adjusting coefficients within a code architecture that could not represent the target physics, and could not re-evaluate its CLASS-PT branch choice even when prompted to reconsider; only an injected physics concept (anisotropic BAO damping) triggered the redesign. Separately, the agent committed a calibrated correction that passed all oracle tests but corresponded to no quantity in the theory, predicting wrong values at any other cosmology. The fudge factor was caught and replaced within the same session. Three supervision practices proved critical for catching what oracle tests missed: testing at diverse parameter points beyond the fiducial calibration; shared changelogs that surfaced stalled exploration across sessions; and an explicit rule against unphysical numerical patches. In this case, supervision design, not model capability, determined whether the agent's output was trustworthy. Closing the gap would require agents that propose architectural alternatives rather than optimize within a given structure, and distinguish predictive adequacy from explanatory correctness -- capabilities not exhibited here, not obviously addressed by scaling alone. [Abridged.]

  • 1 authors
·
May 27

Classical Capacity of Single-Mode Bosonic Gaussian Channels

The classical capacity of a noisy optical channel is the maximum rate at which information can be transmitted reliably, given a constraint on the mean input energy. For the ubiquitous bosonic Gaussian channels, which include standard models of loss and noise in fibre and free-space optical links, determining this rate requires addressing whether entanglement between channel uses or non-Gaussian signals can outperform Gaussian encodings. More precisely, the question is whether the energy-constrained Holevo information is additive across arbitrarily many channel uses and coincides with its Gaussian counterpart. We answer these fundamental questions in the affirmative for every single-mode bosonic Gaussian channel at every input energy. Namely, we prove that independently prepared Gaussian states with Gaussian-distributed random displacements achieve the capacity, including in the low-energy regime where squeezing the signals competes with encoding information in their displacement. Our proof connects an entanglement inequality to a sharp, additive lower bound on output entropy. We then characterise communication above capacity: under a strict total photon-number cutoff, the probability of correct decoding decreases exponentially with the number of channel uses, and we derive explicit bounds on the decay exponent. When only the mean photon number is constrained, a simple energy-rescaling formula determines exactly the entire asymptotic rate--error trade-off: the capacity at mean photon number N and allowed average decoding error ε equals the vanishing-error capacity at mean photon number N/(1-ε). Together, these results identify the ultimate limits of classical communication for some of the most fundamental models of optical communication.

  • 3 authors
·
Oct 14

OAM-Induced Lattice Rotation Reveals a Fractional Optimum in Fault-Tolerant GKP Quantum Sensing

Photon loss and dephasing rapidly degrade the sensitivity of quantum sensors, yet systematic methods for designing error-correcting codes whose geometry is simultaneously adapted to the sensing task and the noise channel do not exist. Here we establish that orbital-angular-momentum (OAM) encoding and Gottesman-Kitaev-Preskill (GKP) lattice geometry are structurally coupled: an OAM mode of topological charge ell induces a phase-space rotation θ_ell=ellπ/ell_{max}, corresponding to a family of twisted GKP stabilizer lattices. Using an end-to-end differentiable Strawberry Fields--TensorFlow circuit, we jointly optimise ell, the lattice aspect ratio r, and the finite-energy envelope ε to maximise quantum Fisher information subject to P_{rm err}leq10^{-3}. The optimum occurs at the fractional charge ell=1.5 (θ=67.5^circ), implementable with a half-integer spiral phase plate, which reduces P_{rm err} by 23.9times relative to the square-lattice baseline while leaving F_Q unchanged to within 0.2%. This surpasses the best integer value (ell=2, 15.7times) and arises from an exact 180^circ periodicity of the P_{rm err}(θ) landscape, confirmed analytically and numerically. We derive a transcendental balance equation for the optimal angle θ^*(η,γ,r) and prove that it decreases with both γ and η. A Shannon-inspired metrological capacity C=F_Qcdot(-ln P_{rm err}), maximised at ell=1.5 with a 41% gain over the square lattice, quantifies the joint sensitivity--fault-tolerance resource. These results establish a geometric design principle for noise-adaptive quantum sensors and a fully open-source differentiable template extensible to other bosonic code families.

  • 2 authors
·
May 13

How Many Code and Test Cases Are Enough? Evaluating Test Cases Generation from a Binary-Matrix Perspective

Evaluating test cases automatically generated by Large Language Models (LLMs) is a critical yet challenging task. Existing benchmarks often evaluate the exclusion ratio on large, unstructured collections of wrong codes, suffering from high computational costs and score inflation. Furthermore, they inadvertently reward generators that detect common, trivial bugs, while failing to penalize their inability to identify rare yet critical faults. In this work, we connect two fundamental questions: (1) What is the minimal set of wrong codes sufficient to represent the entire error space? and (2) What is the minimal set of test cases needed to distinguish them? We introduce a novel framework that formalizes benchmark construction as finding an optimal diagnostic basis in a binary code-test matrix, where rows represent wrong codes and columns represent test case results. The rank of this matrix specifies the minimal number of independent error patterns (wrong codes) and provides a tight upper bound on the number of test cases required for complete fault coverage. Our objective is to identify a basis of size equal to the matrix rank that maximizes internal diversity. To tackle this NP-hard problem, we propose WrongSelect, an efficient approximation algorithm to select maximally diverse wrong codes. Applying this framework to millions of competitive programming submissions, we construct TC-Bench, a compact, diverse, and inflation-resistant benchmark. Extensive experiments show that even the most advanced test case generation methods achieve only ~60% exclusion rates on TC-Bench, exposing a significant gap in their diagnostic power and highlighting substantial room for future improvement. Our dataset is available at: https://huggingface.co/datasets/Luoberta/TC-Bench and our code is at: https://github.com/Luowaterbi/TC-Bench.

  • 8 authors
·
Oct 9, 2025

Tracing cosmic voids with fast simulations

Context. Cosmic voids are vast underdense regions in the cosmic web that encode crucial information about structure formation, the composition of the Universe, and its expansion history. Due to their lower density, these regions are less affected by non-linear gravitational dynamics, making them suitable candidates for analysis using semi-analytic methods. Aims. We assess the accuracy of the PINOCCHIO code, a fast tool for generating dark matter halo catalogs based on Lagrangian Perturbation Theory, in modeling the statistical properties of cosmic voids. We validate this approach by comparing the resulting void statistics measured from PINOCCHIO to those obtained from N-body simulations. Methods. We generate a set of simulations using PINOCCHIO and OpenGADGET3, assuming a fiducial cosmology and varying the resolution. For a given resolution, the simulations share the same initial conditions between the different simulation codes. Snapshots are saved at multiple redshifts for each simulation and post-processed using the watershed void finder VIDE to identify cosmic voids. For each simulation code, we measure the following statistics: void size function, void ellipticity function, core density function, and the void radial density profile. We use these statistics to quantify the accuracy of PINOCCHIO relative to OpenGADGET3 in the context of cosmic voids. Results. We find agreement for all void statistics at better than 2{\sigma} between PINOCCHIO and OpenGADGET3, with no systematic difference in redshift trends. This demonstrates that the PINOCCHIO code can reliably produce void statistics with high computational efficiency compared to full N-body simulations.

  • 6 authors
·
Jun 24, 2025

Hadronic light-by-light contribution to (g-2)_μ from lattice QCD with SU(3) flavor symmetry

We perform a lattice QCD calculation of the hadronic light-by-light contribution to (g-2)_μ at the SU(3) flavor-symmetric point m_π=m_Ksimeq 420,MeV. The representation used is based on coordinate-space perturbation theory, with all QED elements of the relevant Feynman diagrams implemented in continuum, infinite Euclidean space. As a consequence, the effect of using finite lattices to evaluate the QCD four-point function of the electromagnetic current is exponentially suppressed. Thanks to the SU(3)-flavor symmetry, only two topologies of diagrams contribute, the fully connected and the leading disconnected. We show the equivalence in the continuum limit of two methods of computing the connected contribution, and introduce a sparse-grid technique for computing the disconnected contribution. Thanks to our previous calculation of the pion transition form factor, we are able to correct for the residual finite-size effects and extend the tail of the integrand. We test our understanding of finite-size effects by using gauge ensembles differing only by their volume. After a continuum extrapolation based on four lattice spacings, we obtain a_μ^{rm hlbl} = (65.4pm 4.9 pm 6.6)times 10^{-11}, where the first error results from the uncertainties on the individual gauge ensembles and the second is the systematic error of the continuum extrapolation. Finally, we estimate how this value will change as the light-quark masses are lowered to their physical values.

  • 5 authors
·
Jul 12, 2020

Amplitude Encoding of Slater-Type Orbitals via Matrix Product States: Efficient State Preparation and Integral Evaluation on Quantum Hardware

Slater-type orbitals (STOs) provide the physically correct description of atomic wavefunctions but have been largely replaced by Gaussian-type orbitals in computational chemistry due to the lack of closed-form multi-center integrals. We present a systematic study of amplitude encoding of STOs on quantum computers using matrix product states (MPS). For one-dimensional orbital functions of the form p_d(x) e^{-ζx}, we derive analytical MPS constructions with constant bond dimension χ= d + 1, requiring O(n) classical and quantum resources for n-qubit registers with no grid sampling. We demonstrate a complete one-electron integral pipeline -- overlap, kinetic energy, and nuclear attraction -- in one dimension, validating the overlap and kinetic energy on IBM Heron processors at 5~qubits with 0.67\% hardware-induced error using Zero-Noise Extrapolation. In three dimensions, we compute multi-center overlap integrals between 1s and 2s orbitals in Cartesian coordinates with 0.02\% discretization error at 18~qubits. A systematic entanglement analysis reveals that the MPS bond dimension of three-dimensional STOs in Cartesian coordinates saturates with increasing grid resolution -- reaching sim138 for the hydrogen 1s orbital at 12~qubits per coordinate -- establishing bounded encoding complexity rather than the exponential scaling initially expected. The SVD truncation threshold provides a practical resource parameter, reducing the bond dimension to 39 at threshold 10^{-6} with negligible accuracy loss. These results map the entanglement landscape for amplitude encoding of atomic orbitals and establish MPS-based state preparation as a viable path toward exact STO basis sets on quantum computers.

  • 1 authors
·
Apr 28

Large Language Model-Guided Discovery of Weight-Five Bivariate Bicycle Codes

Building on our earlier program-evolution workflow guided by large language models (LLMs), we study weight-five bivariate bicycle (BB) and perturbed bivariate bicycle (PBB) codes. The resulting catalogue contains 1,142 distinct code proposals, including 1,081 nonbaseline proposals attributable to LLM-generated programs. Across the catalogue, we certify connected Calderbank--Shor--Steane (CSS) realizations [[96,4,10]], [[140,6,10]], and [[180,4,14]]. A post-search comparison certifies seven imported Lin--Pryadko archive constructions. For leading parameter triples also represented in that archive, we provide exact distance evidence, explicit bivariate presentations, and verified component reductions. A basis-independent connectivity analysis identifies 409 of the 1,142 catalogue entries as disconnected and shows that 73.1\% of the classes with exact distance certificates contain repeated connected components. Algebraic analysis organizes the connected CSS classes into order-3, order-7, and order-15 cyclotomic-kernel strata. The strongest exact connected PBB parameter point is [[216,4,10]], attained by two distinct component classes. Among the 936 distinct CSS proposals from the LLM-guided campaign with a recorded positive distance, 816 (87.18\%) are certified at dgeq5. For comparison, three random-search controls each sample 6,444 CSS code proposals uniformly without replacement, using the same per-lattice and encoded-dimension sample counts as the LLM-guided campaign. In these controls, 4,672--4,785 proposals (72.50--74.26\%) meet the same criterion. The LLM-guided campaign has the higher certified yield, while the random controls cover more connected classes. Together, these results extend LLM-guided discovery to a more constrained code family and provide a reproducible structural and exact-distance account of its strongest candidates.

  • 1 authors
·
Oct 4

Stability of Quantum LDPC States under Local Pauli Noise

Quantum low-density parity-check (qLDPC) codes have a canonical mixed state---the normalized projector onto the code space---that lies at the intersection of quantum error correction and quantum many-body physics, yet the stability of its information-theoretic structure under local noise remains poorly understood. Recent progress on mixed-state phases of matter has identified the spatial decay of conditional mutual information (CMI) I(A:C|B) as a key diagnostic of such stability, analogous to the role of the spectral gap for quantum ground states. We prove that, for the normalized code-projector state of a Z_d qLDPC stabilizer code under local Pauli noise, the CMI across a buffer B separating A from C decays exponentially with the width of B in two complementary noise regimes independent of system size. At weak noise, this holds for full-system tripartitions, where correlations between the two sides require an error cluster to cross the buffer, an exponentially unlikely event. At strong noise, exponential decay holds whenever the buffer supports no logical operator, since correlations can persist only along rare chains of buffer qudits that remain informative. Under an additional space-uniformity assumption, we establish the robustness of Levin--Wen topological entropy. On finite-dimensional lattices of size n, the weak-noise bound further implies a constant-layer quasi-local Petz recovery channel of range O(poly(log n)/varepsilon) that recovers the noiseless state within trace-distance error varepsilon. Both CMI bounds apply to general qLDPC interaction graphs, including geometries where such constant-depth quasi-local recovery need not exist. Thus, the exponential decay of the noise-induced CMI provides a general criterion for mixed-state phase stability.

  • 4 authors
·
Oct 14

AST-Probe: Recovering abstract syntax trees from hidden representations of pre-trained language models

The objective of pre-trained language models is to learn contextual representations of textual data. Pre-trained language models have become mainstream in natural language processing and code modeling. Using probes, a technique to study the linguistic properties of hidden vector spaces, previous works have shown that these pre-trained language models encode simple linguistic properties in their hidden representations. However, none of the previous work assessed whether these models encode the whole grammatical structure of a programming language. In this paper, we prove the existence of a syntactic subspace, lying in the hidden representations of pre-trained language models, which contain the syntactic information of the programming language. We show that this subspace can be extracted from the models' representations and define a novel probing method, the AST-Probe, that enables recovering the whole abstract syntax tree (AST) of an input code snippet. In our experimentations, we show that this syntactic subspace exists in five state-of-the-art pre-trained language models. In addition, we highlight that the middle layers of the models are the ones that encode most of the AST information. Finally, we estimate the optimal size of this syntactic subspace and show that its dimension is substantially lower than those of the models' representation spaces. This suggests that pre-trained language models use a small part of their representation spaces to encode syntactic information of the programming languages.

  • 4 authors
·
Jun 23, 2022

Fast and accurate AI-based pre-decoders for color codes

Color codes are promising alternatives to surface codes for universal fault-tolerant quantum computing due to their simpler lattice-surgery protocols and the transversal implementation of logical Clifford gates. However, their practical deployment has been limited by slower decoding algorithms and worse logical failure rates and thresholds compared to surface codes. Although AI-based logical-flip decoders have recently been proposed to address these challenges, no clear framework currently exists for implementing such decoders within the parallel block-wise decoding schemes in both space and time required for large-scale fault-tolerant computation. AI-based pre-decoders offer a scalable alternative due to their local nature. By performing spacelike corrections on physical qubits and timelike corrections on stabilizer measurements, pre-decoders are naturally compatible with parallel block-wise decoding schemes and lattice-surgery protocols. In this work, we introduce AI-based pre-decoders for triangular color codes. We present a novel neural-network architecture for their implementation and develop methods to simplify the complex training data generated by color-code syndrome-extraction circuits containing feedforward operations. Remarkably, we find that both logical failure rates (LERs) and runtimes improve relative to raw Chromobius decoding as the code distance increases. For example, at code distance d=31 and physical error rate p=0.3%, our pre-decoder + Chromobius pipeline improves the logical failure rate by a factor of 347x while reducing runtime by 7.33x compared to raw Chromobius decoding alone. These results demonstrate that AI-based pre-decoding can substantially narrow the performance gap between color codes and surface codes, bringing color codes closer to practical large-scale fault-tolerant quantum computation.

  • 4 authors
·
Jul 10

Principled Approaches for Extending Neural Architectures to Function Spaces for Operator Learning

A wide range of scientific problems, such as those described by continuous-time dynamical systems and partial differential equations (PDEs), are naturally formulated on function spaces. While function spaces are typically infinite-dimensional, deep learning has predominantly advanced through applications in computer vision and natural language processing that focus on mappings between finite-dimensional spaces. Such fundamental disparities in the nature of the data have limited neural networks from achieving a comparable level of success in scientific applications as seen in other fields. Neural operators are a principled way to generalize neural networks to mappings between function spaces, offering a pathway to replicate deep learning's transformative impact on scientific problems. For instance, neural operators can learn solution operators for entire classes of PDEs, e.g., physical systems with different boundary conditions, coefficient functions, and geometries. A key factor in deep learning's success has been the careful engineering of neural architectures through extensive empirical testing. Translating these neural architectures into neural operators allows operator learning to enjoy these same empirical optimizations. However, prior neural operator architectures have often been introduced as standalone models, not directly derived as extensions of existing neural network architectures. In this paper, we identify and distill the key principles for constructing practical implementations of mappings between infinite-dimensional function spaces. Using these principles, we propose a recipe for converting several popular neural architectures into neural operators with minimal modifications. This paper aims to guide practitioners through this process and details the steps to make neural operators work in practice. Our code can be found at https://github.com/neuraloperator/NNs-to-NOs

  • 7 authors
·
Jun 12, 2025

Neural networks behave as hash encoders: An empirical study

The input space of a neural network with ReLU-like activations is partitioned into multiple linear regions, each corresponding to a specific activation pattern of the included ReLU-like activations. We demonstrate that this partition exhibits the following encoding properties across a variety of deep learning models: (1) {\it determinism}: almost every linear region contains at most one training example. We can therefore represent almost every training example by a unique activation pattern, which is parameterized by a {\it neural code}; and (2) {\it categorization}: according to the neural code, simple algorithms, such as K-Means, K-NN, and logistic regression, can achieve fairly good performance on both training and test data. These encoding properties surprisingly suggest that {\it normal neural networks well-trained for classification behave as hash encoders without any extra efforts.} In addition, the encoding properties exhibit variability in different scenarios. {Further experiments demonstrate that {\it model size}, {\it training time}, {\it training sample size}, {\it regularization}, and {\it label noise} contribute in shaping the encoding properties, while the impacts of the first three are dominant.} We then define an {\it activation hash phase chart} to represent the space expanded by {model size}, training time, training sample size, and the encoding properties, which is divided into three canonical regions: {\it under-expressive regime}, {\it critically-expressive regime}, and {\it sufficiently-expressive regime}. The source code package is available at https://github.com/LeavesLei/activation-code.

  • 4 authors
·
Jan 14, 2021

Sequential quantum simulation of spin chains with a single circuit QED device

Quantum simulation of many-body systems in materials science and chemistry are promising application areas for quantum computers. However, the limited scale and coherence of near-term quantum processors pose a significant obstacle to realizing this potential. Here, we theoretically outline how a single-circuit quantum electrodynamics (cQED) device, consisting of a transmon qubit coupled to a long-lived cavity mode, can be used to simulate the ground state of a highly-entangled quantum many-body spin chain. We exploit recently developed methods for implementing quantum operations to sequentially build up a matrix product state (MPS) representation of a many-body state. This approach re-uses the transmon qubit to read out the state of each spin in the chain and exploits the large state space of the cavity as a quantum memory encoding inter-site correlations and entanglement. We show, through simulation, that analog (pulse-level) control schemes can accurately prepare a known MPS representation of a quantum critical spin chain in significantly less time than digital (gate-based) methods, thereby reducing the exposure to decoherence. We then explore this analog-control approach for the variational preparation of an unknown ground state. We demonstrate that the large state space of the cavity can be used to replace multiple qubits in a qubit-only architecture, and could therefore simplify the design of quantum processors for materials simulation. We explore the practical limitations of realistic noise and decoherence and discuss avenues for scaling this approach to more complex problems that challenge classical computational methods.

  • 5 authors
·
Aug 29, 2023

Scaling Particle Collision Data Analysis

For decades, researchers have developed task-specific models to address scientific challenges across diverse disciplines. Recently, large language models (LLMs) have shown enormous capabilities in handling general tasks; however, these models encounter difficulties in addressing real-world scientific problems, particularly in domains involving large-scale numerical data analysis, such as experimental high energy physics. This limitation is primarily due to BPE tokenization's inefficacy with numerical data. In this paper, we propose a task-agnostic architecture, BBT-Neutron, which employs a binary tokenization method to facilitate pretraining on a mixture of textual and large-scale numerical experimental data. We demonstrate the application of BBT-Neutron to Jet Origin Identification (JoI), a critical categorization challenge in high-energy physics that distinguishes jets originating from various quarks or gluons. Our results indicate that BBT-Neutron achieves comparable performance to state-of-the-art task-specific JoI models. Furthermore, we examine the scaling behavior of BBT-Neutron's performance with increasing data volume, suggesting the potential for BBT-Neutron to serve as a foundational model for particle physics data analysis, with possible extensions to a broad spectrum of scientific computing applications for Big Science experiments, industrial manufacturing and spacial computing. The project code is available at https://github.com/supersymmetry-technologies/bbt-neutron.

  • 13 authors
·
Nov 28, 2024

BOCoDe: Engineering-Centered Benchmarking for Bayesian Optimization

Bayesian optimization (BO) is a sample-efficient, surrogate-based approach to black-box optimization (BBO), but its evaluation remains dominated by synthetic functions and hyperparameter optimization (HPO) tasks that are typically low-dimensional and single-objective. Engineering design poses a substantially different regime: problems are physics-based, often high-dimensional, constrained by requirements such as cost and manufacturability, and may involve multiple objectives or mixed variables. To close this benchmarking gap, we introduce BOCoDe, an open-source, PyTorch-native benchmark comprising 307 BBO problems, including 159 engineering design tasks and widely used synthetic and HPO benchmarks. Each problem includes cited provenance and machine-readable metadata that supports programmatic discovery, including by LLM-based agents, and all tasks are exposed through a unified API compatible with open-source BO libraries. We evaluate 31 BO and evolutionary algorithms across five problem classes spanning single- and multi-objective optimization, constrained and unconstrained settings, and mixed-variable search spaces. Analyses of problem structure show that engineering tasks uniquely span constrained and multi-objective settings that synthetic and HPO suites rarely cover, while embeddings from a tabular foundation model separate them most clearly from HPO tasks. Algorithm rankings also vary substantially across domains; in several problem classes, rankings obtained on standard benchmarks do not transfer to engineering tasks. BOCoDe establishes a reproducible and extensible foundation for developing and evaluating BO methods that better reflect the demands of engineering design. Code & data can be found at https://github.com/rosenyu304/BOCoDe

  • 5 authors
·
Aug 14

PAC Prediction Sets for Large Language Models of Code

Prediction sets have recently been shown to be a promising strategy for quantifying the uncertainty of deep neural networks in a way that provides theoretical guarantees. However, existing techniques have largely targeted settings where the space of labels is simple, so prediction sets can be arbitrary subsets of labels. For structured prediction problems where the space of labels is exponential in size, even prediction sets containing a small fraction of all labels can be exponentially large. In the context of code generation, we propose a solution that considers a restricted set of prediction sets that can compactly be represented as partial programs, which are programs with portions replaced with holes. Given a trained code generation model, our algorithm leverages a programming language's abstract syntax tree to generate a set of programs such that the correct program is in the set with high-confidence. Valuable applications of our algorithm include a Codex-style code generator with holes in uncertain parts of the generated code, which provides a partial program with theoretical guarantees. We evaluate our approach on PICARD (a T5 model for SQL semantic parsing) and Codex (a GPT model for over a dozen programming languages, including Python), demonstrating that our approach generates compact PAC prediction sets. This is the first research contribution that generates PAC prediction sets for generative code models.

  • 3 authors
·
Feb 17, 2023

A PennyLane-Centric Dataset to Enhance LLM-based Quantum Code Generation using RAG

Large Language Models (LLMs) offer powerful capabilities in code generation, natural language understanding, and domain-specific reasoning. Their application to quantum software development remains limited, in part because of the lack of high-quality datasets both for LLM training and as dependable knowledge sources. To bridge this gap, we introduce PennyLang, an off-the-shelf, high-quality dataset of 3,347 PennyLane-specific quantum code samples with contextual descriptions, curated from textbooks, official documentation, and open-source repositories. Our contributions are threefold: (1) the creation and open-source release of PennyLang, a purpose-built dataset for quantum programming with PennyLane; (2) a framework for automated quantum code dataset construction that systematizes curation, annotation, and formatting to maximize downstream LLM usability; and (3) a baseline evaluation of the dataset across multiple open-source and commercial models, including ablation studies, all conducted within a retrieval-augmented generation (RAG) pipeline. Using PennyLang with RAG substantially improves performance: for example, Qwen 7B's success rate rises from 8.7% without retrieval to 41.7% with full-context augmentation, and LLaMa 4 improves from 78.8% to 84.8%, while also reducing hallucinations and enhancing quantum code correctness. Moving beyond Qiskit-focused studies, we bring LLM-based tools and reproducible methods to PennyLane for advancing AI-assisted quantum development.

  • 7 authors
·
Apr 15

Continuum Attention for Neural Operators

Transformers, and the attention mechanism in particular, have become ubiquitous in machine learning. Their success in modeling nonlocal, long-range correlations has led to their widespread adoption in natural language processing, computer vision, and time series problems. Neural operators, which map spaces of functions into spaces of functions, are necessarily both nonlinear and nonlocal if they are universal; it is thus natural to ask whether the attention mechanism can be used in the design of neural operators. Motivated by this, we study transformers in the function space setting. We formulate attention as a map between infinite dimensional function spaces and prove that the attention mechanism as implemented in practice is a Monte Carlo or finite difference approximation of this operator. The function space formulation allows for the design of transformer neural operators, a class of architectures designed to learn mappings between function spaces. In this paper, we state and prove the first universal approximation result for transformer neural operators, using only a slight modification of the architecture implemented in practice. The prohibitive cost of applying the attention operator to functions defined on multi-dimensional domains leads to the need for more efficient attention-based architectures. For this reason we also introduce a function space generalization of the patching strategy from computer vision, and introduce a class of associated neural operators. Numerical results, on an array of operator learning problems, demonstrate the promise of our approaches to function space formulations of attention and their use in neural operators.

  • 4 authors
·
Dec 19, 2025

Benchmarking API Drift in LLM-Generated Quantum Code Across Successive SDK Versions

Large language models can generate plausible quantum code, but it is unclear whether they can reliably target the specific software development kit (SDK) version requested by the user. We study this problem as API drift and introduce quantum-api-drift, a benchmark for measuring version fidelity, defined here as execution success on the requested SDK version, cross-version compatibility, failure modes, and documentation-guided repair in LLM-generated quantum SDK code. We instantiate the benchmark with Qiskit, a representative quantum SDK that underwent substantial interface changes across v0.43, v1.3, and v2.0. We evaluate 17 models on 50 tasks with 3 samples per prompt, yielding 450 generated samples and 1,350 executions per model. Sixteen models are tested in a matched REST API setting with a 1024-token output cap, while GPT-5.4 (Codex CLI) is reported separately as a reference configuration. Across the 16 matched REST models, diagonal Pass@1 ranges from 0.02 to 0.85. Claude Opus 4.7 is strongest on v0.43 and v2.0, while Grok 4.20 is strongest on v1.3 at 0.513. Error profiles differ systematically by model strength: weaker models fail mainly with broken imports, while stronger models more often reach deprecation-level failures. Documentation-guided repair succeeds for 0.19 to 0.59 of repair attempts overall and is consistently much more effective for migration to v2.0 than to v1.3. The benchmark artifacts are publicly available at https://github.com/arasyi/quantum-api-drift. These results show that version alignment is a distinct evaluation axis for quantum code generation and that API drift remains only partly recoverable even with migration guidance.

  • 2 authors
·
Jul 4

3DCodeVerse: Exploring 3D Worlds as Code

We introduce 3DCodeVerse, a research ecosystem that enables coding agents to create editable and verifiable 3D content at scale. 3DCodeVerse comprises large-scale, high-quality datasets of executable 3D code, a coding harness for spatial reasoning and automated verification, and practical guidance for 3D coding. First, we construct 3DCodeVerse-2M, a large-scale curated dataset of standalone 3D executable code. We build this corpus by collecting open-source data, converting specialized representations, and generating new programs with coding agents. Each program is packaged with the source files and associated assets required for execution in its declared environment, along with available descriptions and verification records. Second, we develop the 3DCodeVerse Harness, a multi-agent directed acyclic graph framework for generating and refining 3D content. It uses execution checks, spatial measurements, and visual feedback to automatically evaluate and revise generated programs without human feedback during generation. Third, we conduct systematic empirical studies of 3D coding, establishing baselines with fine-tuned open models and deriving practical guidance through component-level analyses of our harness. Extensive experiments demonstrate that fine-tuning on our dataset significantly improves the 3D coding capabilities of open-source models. Notably, our 3DCodeVerse harness achieves a 90% win rate against Claude Design (3D Object) in pairwise human evaluations, when both are utilized by Claude Opus 5.5.

What Shape is the Inflationary Bispectrum?

Non-linear interactions during inflation generate non-Gaussianities in the distribution of primordial curvature. In many theories, the physics is scale-invariant, such that the induced three-point function depends solely on a dimensionless shape function S(x,y)sim k^6B_ζ(kx,ky,k). To confront such models with observations, one typically builds specialized estimators for each shape, then applies them to cosmic microwave background datasets at significant computational expense. In this Letter, we take a different approach, directly reconstructing S(x,y) from observations using an efficient logarithmically-binned estimator in primordial-space (motivated by the modal program). Applying this to temperature and polarization maps from Planck, we obtain high-resolution shape measurements across the full (x,y)-plane, including squeezed limits. Our approach is close-to-optimal, highly interpretable, and preserves the information content on (optimally-analyzed) standard templates within approx 10%; moreover, we can use it to assess the scale-dependence of our constraints, finding that Planck is sensitive to approx 6 e-folds of non-Gaussian evolution with a peak sensitivity around 0.1h,Mpc^{-1}. Since we work directly in shape-space, data and theory can be compared in milliseconds. As an example, we perform a search for massive particle exchange using a suite of over 20,000 theoretical templates computed with exact bootstrap methods (for the first time) across a wide range of masses, spins, and sound-speeds; the spin-two analysis yields a maximum significance of 2.6σ. Our approach can be used to probe a wide range of scale-invariant models in orders-of-magnitude less time than with direct estimators, allowing the inflationary paradigm to be explored in new ways.

  • 1 authors
·
Mar 25

Naturalness and the muon magnetic moment

We study a predictive model for explaining the apparent deviation of the muon anomalous magnetic moment from the Standard Model expectation. There are no new scalars and hence no new hierarchy puzzles beyond those associated with the Higgs; the only new particles at the TeV scale are vector-like singlet and doublet leptons. Interestingly, this simple model provides a calculable example violating the Wilsonian notion of naturalness: despite the absence of any symmetries prohibiting its generation, the coefficient of the naively leading dimension-six operator for (g-2) vanishes at one-loop. While effective field theorists interpret this either as a surprising UV cancellation of power divergences, or as a delicate cancellation between matching UV and calculable IR corrections to (g-2) from parametrically separated scales, there is a simple explanation in the full theory: the loop integrand is a total derivative of a function vanishing in both the deep UV and IR. The leading contribution to (g-2) arises from dimension-eight operators, and thus the required masses of new fermions are lower than naively expected, with a sizeable portion of parameter space already covered by direct searches at the LHC. The viable parameter space free of fine-tuning for the muon mass will be fully covered by future direct LHC searches, and {\it all} of the parameter space can be probed by precision measurements at planned future lepton colliders.

  • 2 authors
·
Jun 25, 2021

CodeTree: Agent-guided Tree Search for Code Generation with Large Language Models

Pre-trained on massive amounts of code and text data, large language models (LLMs) have demonstrated remarkable achievements in performing code generation tasks. With additional execution-based feedback, these models can act as agents with capabilities to self-refine and improve generated code autonomously. However, on challenging coding tasks with extremely large search space, current agentic approaches still struggle with multi-stage planning, generating, and debugging. To address this problem, we propose CodeTree, a framework for LLM agents to efficiently explore the search space in different stages of the code generation process. Specifically, we adopted a unified tree structure to explicitly explore different coding strategies, generate corresponding coding solutions, and subsequently refine the solutions. In each stage, critical decision-making (ranking, termination, expanding) of the exploration process is guided by both the environmental execution-based feedback and LLM-agent-generated feedback. We comprehensively evaluated CodeTree on 7 code generation benchmarks and demonstrated the significant performance gains of CodeTree against strong baselines. Using GPT-4o as the base model, we consistently achieved top results of 95.1 on HumanEval, 98.7 on MBPP, and 43.0 on CodeContests. On the challenging SWEBench benchmark, our approach led to significant performance gains.

  • 6 authors
·
Nov 6, 2024

Discovering highly efficient low-weight quantum error-correcting codes with reinforcement learning

The realization of scalable fault-tolerant quantum computing is expected to hinge on quantum error-correcting codes. In the quest for more efficient quantum fault tolerance, a critical code parameter is the weight of measurements that extract information about errors to enable error correction: as higher measurement weights require higher implementation costs and introduce more errors, it is important in code design to optimize measurement weight. This underlies the surging interest in quantum low-density parity-check (qLDPC) codes, the study of which has primarily focused on the asymptotic (large-code-limit) properties. In this work, we introduce a versatile and computationally efficient approach to stabilizer code weight reduction based on reinforcement learning (RL), which produces new low-weight codes that substantially outperform the state of the art in practically relevant parameter regimes, extending significantly beyond previously accessible small distances. For example, our approach demonstrates savings in physical qubit overhead compared to existing results by 1 to 2 orders of magnitude for weight 6 codes and brings the overhead into a feasible range for near-future experiments. We also investigate the interplay between code parameters using our RL framework, offering new insights into the potential efficiency and power of practically viable coding strategies. Overall, our results demonstrate how RL can effectively advance the crucial yet challenging problem of quantum code discovery and thereby facilitate a faster path to the practical implementation of fault-tolerant quantum technologies.

  • 2 authors
·
Feb 20, 2025 4

Perturbative Reconstruction of Self-Adjoint Generators from Bosonic Canonical Commutation Relations: Application to the Null-Surface Formulation

We study the inverse adjoint problem for a perturbative bosonic outgoing map. Within the polynomial bosonic canonical-commutation-relation (CCR) algebra, we prove a constructive integrability theorem: order-by-order preservation of the CCRs is sufficient to reconstruct recursively a formal self-adjoint generator whose exponential implements the outgoing map by adjoint conjugation. At each order, the Baker--Campbell--Hausdorff contribution determined by previously reconstructed generators is subtracted from the outgoing coefficient, and the remaining homogeneous CCR conditions determine the next generator explicitly. We apply the construction to graviton scattering in the null-surface formulation (NSF), specialized to the flat solution-space sector with Minkowski metric, null generators, affine parameter, and cone measure. The NSF outgoing map preserves the Ashtekar radiative CCRs through (δa_3), corresponding to order (\varepsilon^2). At this order, the scalar CCR sector uniquely selects the symmetric ordering (c=1) for the nontrivial interacting kernel. The associated linear contraction, generated by the same cubic kernel, cancels the double-contraction contribution from ([δa_2,δa_2^\dagger]). The theorem then reconstructs the self-adjoint generators (δT_1) and (δT_2), providing a formal perturbative unitary implementation. The resulting canonical organization also separates the direct (2\to2) contribution into irreducible-loop, one-particle-reducible, and factorized sectors.

  • 1 authors
·
Aug 21

Warm-Inflation: a software for first-principles integration of warm inflation power spectra

As part of a PhD thesis entitled `Scalar perturbations in warm inflation and during reheating' we present a software for computing warm inflation observables. In particular, our Mathematica implementation computes the power spectrum, spectral tilt, and tensor-to-scalar ratio for a given momentum scale. Compared with other implementations, we start in a Bunch-Davies state deep inside the horizon, ideally at a time when thermal noise is exponentially suppressed. We integrate gauge-invariant equations for three curvature perturbations across horizon exit. We continue deep enough outside of horizon so that all curvature perturbations agree. Results are illustrated for Standard Model embedded warm inflation, and we also provide notebooks for several other popular potentials and friction coefficients. The theoretical foundations for the code can be found in the main part of the thesis or in earlier papers [1,2]. Specifically, part II derives gauge-invariant, model-agnostic evolution equations, as well as the noise autocorrelator interpolating between quantum and classical domains. Part III presents the general ideas behind the numerical implementation, while part IV presents selected results. The code is described, line-by-line, in Appendix A. The published PhD thesis is available at https://doi.org/10.48620/101166 while the notebooks can be downloaded from https://github.com/alicarogeljblackhole/Warm-Inflation.

  • 1 authors
·
Oct 7

An exactly solvable obstructed seam on a lattice Klein bottle: bulk-locked Majorana rings and register-dependent toric codes

We study a frustrated seam produced by literal reflection gluing of Wen's plaquette model on a closed lattice Klein bottle. The seam operators anticommute along two cycles for even circumference and one cycle of twice the length for odd circumference. Their algebra reduces to free Majorana rings, while the commuting bulk stabilizers constrain the allowed ring sectors. This bulk locking yields exact ground energies, excitation gaps and degeneracies, checked by phase-aware Pauli traces and finite-size diagonalization, including two 24-qubit energy predictions. The seam degeneracy is not topological: the single-site seam fields tested split it at second order. We contrast this obstructed gluing with consistent toric-code realizations. An edge register preserves the anyon labels; a Hadamard-dressed site register has colour-dependent seam transport, with ground-state degeneracy 2 or 4 for even circumference and a sign-frustrated exception at odd circumference. For the enumerated lattice isometries and sizes, we compute logical gates and distances, distinguishing abstract qubit relabelling from local hardware depth. Finally, on three 16- and 24-qubit lattices, chiral matter selects a holonomy doublet whose electric-field splitting follows two competing tunnelling routes. These matter results remain finite-size statements. The main result is the exact obstructed-seam solution with bulk sector locking; the register, gate and matter calculations delimit its relation to topological codes.

  • 2 authors
·
Oct 18

Qudit Designs and Where to Find Them

Unitary t-designs are some of the most versatile tools in quantum information theory. Their applications range from randomized benchmarking and shadow tomography, to more fundamental ones such as emulating quantum chaos and establishing exponential separations between classical and quantum query complexity. While unitary designs originating from a group structure, such as the Clifford group, have proven to be incredibly useful for qubit systems, unfortunately, this is no longer true for qudits. In fact, the classification of finite-group representations rules out the existence of unitary 2-designs for arbitrary qudit dimensions. This severely limits the applicability of standard quantum information primitives when it comes to qudit systems. We overcome these limitations with a three-fold contribution. First, we introduce a general technique to construct families of weighted state t-designs in arbitrary qudit dimensions. These weighted state-designs generalize classical shadow tomography protocol from qubits to qudits. Second, we introduce a Clifford character RB that allows us to benchmark the qudit Clifford group in any dimension, including non-prime-power dimensions. And third, we establish bounds on the quantum circuit complexity of generating approximate unitary-designs from native gates in existing quantum hardware such as high-spin and cavity-QED qudits. Our work further highlights the analogy between spin and optical coherent states by proving that spin-GKP codewords form a state 2-design while spin coherent states do not; in direct analogy with the optical case. This work is structured as a pedagogical and self-contained introduction to unitary designs and their applications to qudit systems.

  • 5 authors
·
Mar 3

Artificial Entanglement in the Fine-Tuning of Large Language Models

Large language models (LLMs) can be adapted to new tasks using parameter-efficient fine-tuning (PEFT) methods that modify only a small number of trainable parameters, often through low-rank updates. In this work, we adopt a quantum-information-inspired perspective to understand their effectiveness. From this perspective, low-rank parameterizations naturally correspond to low-dimensional Matrix Product States (MPS) representations, which enable entanglement-based characterizations of parameter structure. Thereby, we term and measure "Artificial Entanglement", defined as the entanglement entropy of the parameters in artificial neural networks (in particular the LLMs). We first study the representative low-rank adaptation (LoRA) PEFT method, alongside full fine-tuning (FFT), using LLaMA models at the 1B and 8B scales trained on the Tulu3 and OpenThoughts3 datasets, and uncover: (i) Internal artificial entanglement in the updates of query and value projection matrices in LoRA follows a volume law with a central suppression (termed as the "Entanglement Valley"), which is sensitive to hyper-parameters and is distinct from that in FFT; (ii) External artificial entanglement in attention matrices, corresponding to token-token correlations in representation space, follows an area law with logarithmic corrections and remains robust to LoRA hyper-parameters and training steps. Drawing a parallel to the No-Hair Theorem in black hole physics, we propose that although LoRA and FFT induce distinct internal entanglement signatures, such differences do not manifest in the attention outputs, suggesting a "no-hair" property that results in the effectiveness of low rank updates. We further provide theoretical support based on random matrix theory, and extend our analysis to an MPS Adaptation PEFT method, which exhibits qualitatively similar behaviors.

  • 6 authors
·
Jan 11 2

C2|Q>: A Robust Framework for Bridging Classical and Quantum Software Development

QSE is emerging as a critical discipline to make quantum computing accessible to a broader developer community; however, most quantum development environments still require developers to engage with low-level details across the software stack - including problem encoding, circuit construction, algorithm configuration, hardware selection, and result interpretation - making them difficult for classical software engineers to use. To bridge this gap, we present C2|Q>, a hardware-agnostic quantum software development framework that translates specific types of classical specifications into quantum-executable programs while preserving methodological rigor. The framework applies modular SE principles by classifying the workflow into three core modules: an encoder that classifies problems, produces Quantum-Compatible Formats, and constructs quantum circuits, a deployment module that generates circuits and recommends hardware based on fidelity, runtime, and cost, and a decoder that interprets quantum outputs into classical solutions. In evaluation, the encoder module achieved a 93.8% completion rate, the hardware recommendation module consistently selected the appropriate quantum devices for workloads scaling up to 56 qubits. End-to-end experiments on 434 Python programs and 100 JSON problem instances show that the full C2|Q> workflow executes reliably on simulators and can be deployed successfully on representative real quantum hardware, with empirical runs limited to small- and medium-sized instances consistent with current NISQ capabilities. These results indicate that C2|Q> lowers the entry barrier to quantum software development by providing a reproducible, extensible toolchain that connects classical specifications to quantum execution. The open-source implementation of C2|Q> is available at https://github.com/C2-Q/C2Q and as a Python package at https://pypi.org/project/c2q-framework/.

  • 7 authors
·
Oct 3, 2025

Quantum error correction below the surface code threshold

Quantum error correction provides a path to reach practical quantum computing by combining multiple physical qubits into a logical qubit, where the logical error rate is suppressed exponentially as more qubits are added. However, this exponential suppression only occurs if the physical error rate is below a critical threshold. In this work, we present two surface code memories operating below this threshold: a distance-7 code and a distance-5 code integrated with a real-time decoder. The logical error rate of our larger quantum memory is suppressed by a factor of Λ = 2.14 pm 0.02 when increasing the code distance by two, culminating in a 101-qubit distance-7 code with 0.143% pm 0.003% error per cycle of error correction. This logical memory is also beyond break-even, exceeding its best physical qubit's lifetime by a factor of 2.4 pm 0.3. We maintain below-threshold performance when decoding in real time, achieving an average decoder latency of 63 μs at distance-5 up to a million cycles, with a cycle time of 1.1 μs. To probe the limits of our error-correction performance, we run repetition codes up to distance-29 and find that logical performance is limited by rare correlated error events occurring approximately once every hour, or 3 times 10^9 cycles. Our results present device performance that, if scaled, could realize the operational requirements of large scale fault-tolerant quantum algorithms.

  • 249 authors
·
Aug 23, 2024

Paritok-4B: Intent-Conditioned Context Compression for Coding Agents

Coding agents re-send large file reads and tool outputs to a frontier LLM every turn, and this context dominates their token bill. General-purpose prompt compressors are trained on prose and suit code poorly: they paraphrase identifiers and drop the exact spans an agent needs to edit. We present Paritok-4B, a 4B LoRA compressor for coding-agent trajectories built on two commitments. It is extractive: it selects spans rather than rewriting them, and 96.0% of the identifiers, paths, and numbers it emits already appear in its input, holding at 96.2% on held-out SWE-bench Lite output. It is intent-conditioned: told the agent's current task, it acts chiefly inside a retained segment, selecting which lines survive (retained lines are +0.067 more intent-relevant than removed ones, paired 95% CI [+0.056, +0.078]) rather than changing how much is retained. We distil a gpt-4.1-mini teacher over 67,074 real OpenHands trajectories into 40,606 validated examples and fine-tune Qwen3-4B. On all 300 SWE-bench Lite instances, Paritok-4B compresses agent context to 25.7% of its size, 2.0x harder than a gpt-4.1-mini compressor (50.2%) and 2.4x harder than gpt-5 (61.9%), while retaining 86.5% of uncompressed single-shot solve quality. Fed the cat -n line-numbered input real agents produce, it compresses slightly less (27.8%) and retains more (89.3%); there the paired test is informative, with 30 instances solved only uncompressed and 17 only compressed, an exact McNemar p=0.079, so at this sample size compressing context to roughly a quarter of its size does not significantly reduce the solve rate. The model is a 264 MB adapter that self-hosts on one 24 GB GPU with no per-token compressor fee, which at list prices decides the economics: gpt-5 as a compressor is net-negative, costing more than the downstream tokens it saves. Weights, data, and evaluation scripts are open (Apache 2.0).

  • 2 authors
·
Aug 24

LLMs Can Tackle High Energy Theoretical Physics, yet Gaps Remain: Part I, Quantum Field Theory

Beyond math and code, Large language models (LLMs) are beginning to tackle problems that have traditionally required substantial training for theoretical physicists, but it remains unclear how far this capability extends and where it might break. As a first step toward pushing LLMs in high-energy theoretical physics, we introduce QFT-Bench, a benchmark of 75 graduate- to research-level problems requiring extensive reasoning and derivation across core Quantum Field Theory (QFT) subareas. Each question has a well-defined target and closed-form reference answer. Evaluation combines symbolic verification with LLM-based judge. Across 39 proprietary and open-source models, frontier models already demonstrate substantial capabilities on nontrivial QFT calculations, with the strongest models exceeding 95% accuracy. At the same time, clear gaps remain. Even strong models still make errors in calculations, conventions, and instruction following, while weaker models often fail at the level of physical concepts or derivations. We further monitor models' CoTs and show that current models exhibit nontrivial reasoning unfaithfulness, i.e., they could reach correct answers but the reasoning itself does not justify and logically support them. These results provide a quantitative assessment of current LLM capabilities in QFT and a first step toward broader evaluation in high-energy theoretical physics.

  • 6 authors
·
Oct 22

A compact, interrogable Tree Tensor Network Jet Tagger on Lund declustering trees

Jet taggers built on the Lund declustering tree encode QCD radiation structure in the inputs and process it with graph networks. We ask whether the tree itself can also constrain the computation, and what becomes accessible when it does. For this, we construct a novel quantum-inspired Tree Tensor Network (TTN), where a single tensor core is shared among the internal nodes of the Cambridge/Aachen declustering tree, employing Lund coordinates, and with no particle-identification or detector-level information. The construction is based on a strong prior on the radiation history rather than on the constituents, complementary to compact equivariant taggers. Because the same learned map acts identically at every node, the trained model can be evaluated on truncated trees and its latent space compared across recursions, and used to localise where on the Lund jet plane the Pythia and Herwig jet representations diverge, showing the regions of generator-dependent concentration. The χ=8 model has 4014 trainable parameters against approximately 391,000 for LundNet. We evaluate boosted top tagging and quark/gluon discrimination at particle level on Pythia and Herwig samples, in both native (PythiatoPythia) and transfer (PythiatoHerwig) configurations. Despite differing in capacity by two orders of magnitude, the TTN reaches native performance close to LundNet in quark/gluon discrimination, slightly underperforming in top tagging, with a similar Pythia-to-Herwig transfer behavior in both tasks. Finally, we show the behavior of the network as a function of the bond dimension, and as a function of the perturbative scale.

  • 4 authors
·
Oct 7

Scaling a CUDA-Q GQE + QSCI pipeline to 40 qubits for EUV photoresist chemistry

We scale a CUDA-Q-native pipeline coupling a generative quantum eigensolver (GQE) to quantum-selected configuration interaction (QSCI) across active spaces of 14 to 44 qubits, applied to the extreme-ultraviolet (EUV) photoresist chemistry of monoalkyltin oxo-hydroxides. A GPT-2 policy emits UCCSD operator sequences; sampled bitstrings become determinants, diagonalised classically, and a cross-circuit generalised-eigenvalue refinement makes every reported GQE+QSCI energy a variational upper bound. Every rung from 14 to 40 qubits carries an exact CASCI or FCI reference, up to 166 million determinants for SnO at 32 qubits. The pipeline is chemically accurate, below 1.6 mHa, through 30 qubits on methyltin trihydroxide and through 32 on SnO, on the best seed at the top rungs. Circuit depth rather than training length is the scaling lever; the refined subspace grows near-linearly with the operator count while staying a vanishing fraction of the determinant space, 0.017% at the 32-qubit SnO rung. It also runs on the 54-qubit IQM Emerald processor, at the shallow depths its routed two-qubit gates allow, reaching +0.330 mHa for SnO at 14 qubits from a CCSD-amplitude-ordered pool prefix and +3.92 mHa for the industrial n-butyltin ligand at 22 qubits from depth-truncated trained circuits under per-circuit readout self-calibration, 81% of the active-space correlation; classical configuration recovery on those counts tightens the 22-qubit result to +0.18 to 0.21 mHa. For the methyl resist, ionisation collapses the classical UCCSD(T) Sn-C bond dissociation energy from 72.6 to 21.2 kcal/mol, the switch that flips solubility on exposure. Against that, the 40-qubit result is support-limited at 22.8 mHa, the full trained ansatz on hardware awaits better fidelities, and classical subspace expansion reaches the 32 to 40-qubit spaces with no quantum sampler, so that boundary is mapped, not beaten.

  • 2 authors
·
Jul 26

Ground State Preparation via Dynamical Cooling

Quantum algorithms for probing ground-state properties of quantum systems require good initial states. Projection-based methods such as eigenvalue filtering rely on inputs that have a significant overlap with the low-energy subspace, which can be challenging for large, strongly-correlated systems. This issue has motivated the study of physically-inspired dynamical approaches such as thermodynamic cooling. In this work, we introduce a ground-state preparation algorithm based on the simulation of quantum dynamics. Our main insight is to transform the Hamiltonian by a shifted sign function via quantum signal processing, effectively mapping eigenvalues into positive and negative subspaces separated by a large gap. This automatically ensures that all states within each subspace conserve energy with respect to the transformed Hamiltonian. Subsequent time-evolution with a perturbed Hamiltonian induces transitions to lower-energy states while preventing unwanted jumps to higher energy states. The approach does not rely on a priori knowledge of energy gaps and requires no additional qubits to model a bath. Furthermore, it makes mathcal{O}(d^{,3/2}/epsilon) queries to the time-evolution operator of the system and mathcal{O}(d^{,3/2}) queries to a block-encoding of the perturbation, for d cooling steps and an epsilon-accurate energy resolution. Our results provide a framework for combining quantum signal processing and Hamiltonian simulation to design heuristic quantum algorithms for ground-state preparation.

  • 4 authors
·
Apr 8, 2024

Kinematical correlations via κ-Poincaré coproducts

We study a kinematical consequence of the Hopf-algebraic momentum composition law in κ-Minkowski spacetime. The same curved momentum space can be described in different coordinates. In the bicrossproduct basis the ordered-plane-wave labels are the translation-generator eigenvalues, so the relevant map is one-to-one. In the classical basis, instead, the translation eigenvalues P_μ are nonlinearly related to the ordered-plane-wave labels p_μ. This relation can fail to be globally one-to-one in a high-momentum region. When a given classical-basis four-momentum admits more than one real auxiliary preimage, the branch-sensitive quantity P_+equiv P_0+P_4=κe^{p_0/κ} enters the coproduct and resolves the branches in two-particle states. Imposing the vanishing total-momentum constraint therefore gives branch-dependent κ-deformed back-to-back momentum correlations. In a single-branch regime this is just a deformed correlated product, while in a multibranch regime a state specified only by P_μ can be expanded into distinct auxiliary branches. If P_μ are taken as the directly meaningful momenta, the physical content is the resulting deformed correlation pattern. If the auxiliary variables p_μ are assigned operational meaning, the same constrained state can be interpreted as a superposition over different auxiliary branches. We also compare this structure with standard regular self-adjoint nonrelativistic minimal-length models and find no analogous smooth local two-real-branch inversion on their physical domains.

  • 2 authors
·
Jun 1

UCoder: Unsupervised Code Generation by Internal Probing of Large Language Models

Large language models (LLMs) have demonstrated remarkable capabilities in code generation tasks. However, their effectiveness heavily relies on supervised training with extensive labeled (e.g., question-answering pairs) or unlabeled datasets (e.g., code snippets), which are often expensive and difficult to obtain at scale. To address this limitation, this paper introduces a method IPC, an unsupervised framework that leverages Internal Probing of LLMs for Code generation without any external corpus, even unlabeled code snippets. We introduce the problem space probing, test understanding probing, solution space probing, and knowledge consolidation and reinforcement to probe the internal knowledge and confidence patterns existing in LLMs. Further, IPC identifies reliable code candidates through self-consistency mechanisms and representation-based quality estimation to train UCoder (coder with unsupervised learning). We validate the proposed approach across multiple code benchmarks, demonstrating that unsupervised methods can achieve competitive performance compared to supervised approaches while significantly reducing the dependency on labeled data and computational resources. Analytic experiments reveal that internal model states contain rich signals about code quality and correctness, and that properly harnessing these signals enables effective unsupervised learning for code generation tasks, opening new directions for training code LLMs in resource-constrained scenarios.

  • 9 authors
·
Dec 19, 2025 2

Scientific Code Search at Scale: A Multi-Domain Dataset and Benchmark

Scientists increasingly rely on open-source tools to support their research workflows, yet discovering relevant software among over 600 million GitHub repositories remains challenging. Existing code search benchmarks focus on general software engineering tasks and fail to capture the domain-specific vocabulary and needs of scientific computing. We present a curated corpus of 5,264 high-quality, domain-classified scientific repositories spanning five NASA Science Mission Directorate divisions -- Earth Science, Astrophysics, Planetary Science, Heliophysics, and Biological & Physical Sciences -- enriched with cleaned READMEs, extracted topics, and additional context from crawled links. Building on this corpus, we introduce two novel information retrieval benchmarks: (1) a repository search benchmark with 219 expert-curated queries designed by domain scientists, and (2) a large-scale code snippet retrieval benchmark containing 117,950 code snippets and 119,720 queries across seven programming languages. Baseline evaluations on repository search reveal significant performance variation across scientific domains. Code snippet retrieval proves equally challenging, with substantial variation driven by differing documentation practices, coding standards, and programming language conventions across scientific communities. All datasets and benchmarks are publicly released on HuggingFace to support research on scientific tool discovery.

  • 11 authors
·
Jul 2

Leveraging verifiable structure in quantum circuits to find more efficient compilations with agentic AI

We discuss an effective paradigm of utilizing AI agents to better compile quantum circuits when one can constrain bottleneck subroutines to have some form of classically verifiable structure. For example, when critical subroutines are composed exclusively of reversible classical logic, phasing operations, and measurement based uncomputation, one can efficiently simulate execution for classical inputs. This property facilitates efficient certification of approximate circuit synthesis via a form of fuzz testing, provided suitable assumptions on the input distribution. While this pattern was recently exploited to improve quantum cryptanalysis circuits, here we highlight the flexibility of the broader approach by discussing three important applications. (1) The computation of 1/x that bottlenecks real space simulations of the Coulomb operator such as those important for modeling inertial confinement fusion reactors. (2) The decoding of Reed-Solomon codes which bottlenecks the decoded quantum interferometry algorithm when used to approximately solve the optimal polynomial intersection problem. And (3) the quantum look-up tables and controlled application of Givens rotations that bottleneck the most performant quantum algorithms for simulating chemistry in second quantization. We discuss reference implementations of these algorithms and how they can be constrained and verified in the interest of seeding a Kaggle competition designed to accelerate AI-based research into the optimization of their compilation.

  • 6 authors
·
Oct 15

Multiflavor Mott insulators in quantum materials and ultracold atoms

Mott insulators with large and active (or multiflavor) local Hilbert spaces widely occur in quantum materials and ultracold atomic systems, and are dubbed "multiflavor Mott insulators". For these multiflavored Mott insulating materials, the spin-only description with the quadratic spin interactions is often insufficient to capture the major physical processes. In the situation with active orbitals, the Kugel-Khomskii superexchange model was then proposed. We briefly review this historical model and discuss the modern developments beyond the original spin-orbital context. These include and are not restricted to the 4d/5d transition metal compounds with the spin-orbit-entangled J=3/2 quadruplets, the rare-earth magnets with two weakly-separated crystal field doublets, breathing magnets and/or the cluster and molecular magnets, et al. We explain the microscopic origin of the emergent Kugel-Khomskii physics in each realization with some emphasis on the J=3/2 quadruplets, and refer the candidate multiflavor Mott insulators as "J=3/2 Mott insulators". For the ultracold atoms, we review the multiflavor Mott insulator realization with the ultracold alkaline and alkaline-earth atoms on the optical lattices. Despite a large local Hilbert space from the atomic hyperfine spin states, the system could naturally realize a large symmetry group such as the Sp(N) and SU(N) symmetries. These ultracold atomic systems lie in the large-N regime of these symmetry groups and are characterized by strong quantum fluctuations. The Kugel-Khomskii physics and the exotic quantum ground states with the "baryon-like" physics can appear in various limits. We conclude with our vision and outlook on this subject.

  • 2 authors
·
Dec 5, 2021

Autoregressive Transformer Neural Network for Simulating Open Quantum Systems via a Probabilistic Formulation

The theory of open quantum systems lays the foundations for a substantial part of modern research in quantum science and engineering. Rooted in the dimensionality of their extended Hilbert spaces, the high computational complexity of simulating open quantum systems calls for the development of strategies to approximate their dynamics. In this paper, we present an approach for tackling open quantum system dynamics. Using an exact probabilistic formulation of quantum physics based on positive operator-valued measure (POVM), we compactly represent quantum states with autoregressive transformer neural networks; such networks bring significant algorithmic flexibility due to efficient exact sampling and tractable density. We further introduce the concept of String States to partially restore the symmetry of the autoregressive transformer neural network and improve the description of local correlations. Efficient algorithms have been developed to simulate the dynamics of the Liouvillian superoperator using a forward-backward trapezoid method and find the steady state via a variational formulation. Our approach is benchmarked on prototypical one and two-dimensional systems, finding results which closely track the exact solution and achieve higher accuracy than alternative approaches based on using Markov chain Monte Carlo to sample restricted Boltzmann machines. Our work provides general methods for understanding quantum dynamics in various contexts, as well as techniques for solving high-dimensional probabilistic differential equations in classical setups.

  • 4 authors
·
Sep 11, 2020

StarCoder 2 and The Stack v2: The Next Generation

The BigCode project, an open-scientific collaboration focused on the responsible development of Large Language Models for Code (Code LLMs), introduces StarCoder2. In partnership with Software Heritage (SWH), we build The Stack v2 on top of the digital commons of their source code archive. Alongside the SWH repositories spanning 619 programming languages, we carefully select other high-quality data sources, such as GitHub pull requests, Kaggle notebooks, and code documentation. This results in a training set that is 4x larger than the first StarCoder dataset. We train StarCoder2 models with 3B, 7B, and 15B parameters on 3.3 to 4.3 trillion tokens and thoroughly evaluate them on a comprehensive set of Code LLM benchmarks. We find that our small model, StarCoder2-3B, outperforms other Code LLMs of similar size on most benchmarks, and also outperforms StarCoderBase-15B. Our large model, StarCoder2- 15B, significantly outperforms other models of comparable size. In addition, it matches or outperforms CodeLlama-34B, a model more than twice its size. Although DeepSeekCoder- 33B is the best-performing model at code completion for high-resource languages, we find that StarCoder2-15B outperforms it on math and code reasoning benchmarks, as well as several low-resource languages. We make the model weights available under an OpenRAIL license and ensure full transparency regarding the training data by releasing the SoftWare Heritage persistent IDentifiers (SWHIDs) of the source code data.

  • 66 authors
·
Feb 29, 2024 7