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Marek Miller

Publications and source records attributed to Marek Miller.

At least 19 recordsLinked to original sources

Breaking the Illusion of Identity in LLM Tooling

Large language models (LLMs) in research and development toolchains produce output that triggers attribution of agency and understanding -- a cognitive illusion that degrades verification behavior and trust calibration. No existing mitigation provides a systematic, deployable constraint set for output register. This paper proposes seven output-side rules, each targeting a documented linguistic mechanism, and validates them empirically. In 780 two-turn conversations (constrained vs. default register, 30 tasks, 13 replicates, 1560 API calls), anthropomorphic markers dropped from 1233 to 33 (>97% reduction, p < 0.001), outputs were 49% shorter by word count, and adapted AnthroScore confirmed the shift toward machine register (-1.94 vs. -0.96, p < 0.001). The rules are implemented as a configuration-file system prompt requiring no model modification; validation uses a single model (Claude Sonnet 4). Output quality under the constrained register was not evaluated. The mechanism is extensible to other domains.

cs.SE

How to use quantum computers for biomolecular free energies

Free energy calculations are at the heart of physics-based analyses of biochemical processes. They allow us to quantify molecular recognition mechanisms, which determine a wide range of biological phenomena from how cells send and receive signals to how pharmaceutical compounds can be used to treat diseases. Quantitative and predictive free energy calculations require computational models that accurately capture both the varied and intricate electronic interactions between molecules as well as the entropic contributions from motions of these molecules and their aqueous environment. However, accurate quantum-mechanical energies and forces can only be obtained for small atomistic models, not for large biomacromolecules. Here, we demonstrate how to consistently link accurate quantum-mechanical data obtained for substructures to the overall potential energy of biomolecular complexes by machine learning in an integrated algorithm. We do so using a two-fold quantum embedding strategy where the innermost quantum cores are treated at a very high level of accuracy. We demonstrate the viability of this approach for the molecular recognition of a ruthenium-based anticancer drug by its protein target, applying traditional quantum chemical methods. As such methods scale unfavorable with system size, we analyze requirements for quantum computers to provide highly accurate energies that impact the resulting free energies. Once the requirements are met, our computational pipeline FreeQuantum is able to make efficient use of the quantum computed energies, thereby enabling quantum computing enhanced modeling of biochemical processes. This approach combines the exponential speedups of quantum computers for simulating interacting electrons with modern classical simulation techniques that incorporate machine learning to model large molecules.

quant-ph

phase2: Full-State Vector Simulation of Quantum Time Evolution at Scale

Classical simulation of quantum computers is essential for designing and benchmarking quantum algorithms. Here we present phase2, a full-state-vector simulator optimised for sequences of many-qubit Pauli rotations on distributed CPU and GPU clusters. Exploiting the common-suffix structure of Pauli-rotation circuits, the implementation reduces inter-node communication and achieves two orders of magnitude speedup for grouped rotations. We demonstrate weak and strong scaling to 40 qubits across 512 NVIDIA H100 GPUs using 32 TB of distributed memory. Applying the simulator to Hamiltonian time evolution of ruthenium-ligand active spaces up to 40 qubits, we find that the empirical Trotter error lies more than two orders of magnitude below the rigorous analytic upper bound for every active space in which the fit converged (up to 32 qubits). Practical circuit depths and simulation costs are therefore substantially smaller than the conservative estimates suggest.

quant-ph

Phase estimation with partially randomized time evolution

Quantum phase estimation combined with Hamiltonian simulation is the most promising algorithmic framework to computing ground state energies on quantum computers. Its main computational overhead derives from the Hamiltonian simulation subroutine. In this paper we use randomization to speed up product formulas, one of the standard approaches to Hamiltonian simulation. We propose new partially randomized Hamiltonian simulation methods in which some terms are kept deterministically and others are randomly sampled. We perform a detailed resource estimate for single-ancilla phase estimation using partially randomized product formulas for benchmark systems in quantum chemistry and obtain orders-of-magnitude improvements compared to other simulations based on product formulas. When applied to the hydrogen chain, we have numerical evidence that our methods exhibit asymptotic scaling with the system size that is competitive with the best known qubitization approaches.

quant-ph

Quantum reference frames, revisited

The topic of quantum reference frames (QRFs) has attracted a great deal of attention in the recent literature. Potentially, the correct description of such frames is important for both the technological applications of quantum mechanics and for its foundations, including the search for a future theory of quantum gravity. In this letter, we point out potential inconsistencies in the mainstream approach to this subject and propose an alternative definition that avoids these problems. Crucially, we reject the notion that transformations between QRFs can be represented by unitary operators and explain the clear physical reasons for this. An experimental protocol, capable of empirically distinguishing between competing definitions of the term, is also proposed. The implications of the new model, for uncertainty relations, spacetime symmetries, gauge symmetries, the quantisation of gravity, and other foundational issues are discussed, and possible directions for future work in this field are considered.

gr-qc

Generalised Uncertainty Relations from Finite-Accuracy Measurements

In this short note we show how the Generalised Uncertainty Principle (GUP) and the Extended Uncertainty Principle (EUP), two of the most common generalised uncertainty relations proposed in the quantum gravity literature, can be derived within the context of canonical quantum theory, without the need for modified commutation relations. A GUP-type relation naturally emerges when the standard position operator is replaced by an appropriate Positive Operator Valued Measure (POVM), representing a finite-accuracy measurement that localises the quantum wave packet to within a spatial region $σ_g > 0$. This length scale is the standard deviation of the envelope function, $g$, that defines the POVM elements. Similarly, an EUP-type relation emerges when the standard momentum operator is replaced by a POVM that localises the wave packet to within a region $\tildeσ_g > 0$ in momentum space. The usual GUP and EUP are recovered by setting $σ_g \simeq \sqrt{\hbar G/c^3}$, the Planck length, and $\tildeσ_g \simeq \hbar\sqrt{Λ/3}$, where $Λ$ is the cosmological constant. Crucially, the canonical Hamiltonian and commutation relations, and, hence, the canonical Schr{\" o}dinger and Heisenberg equations, remain unchanged. This demonstrates that GUP and EUP phenomenology can be obtained without modified commutators, which are known to lead to various pathologies, including violation of the equivalence principle, violation of Lorentz invariance in the relativistic limit, the reference frame-dependence of the `minimum' length, and the so-called soccer ball problem for multi-particle states.

gr-qc

The power of noisy quantum states and the advantage of resource dilution

Entanglement distillation allows to convert noisy quantum states into singlets, which can in turn be used for various quantum technological tasks, such as quantum teleportation and quantum key distribution. Entanglement dilution is the inverse process: singlets are converted into quantum states with less entanglement. While the usefulness of distillation is apparent, practical applications of entanglement dilution are less obvious. Here, we show that entanglement dilution can increase the resilience of shared quantum states to local noise. The increased resilience is observed even if diluting singlets into states with arbitrarily little entanglement. We extend our analysis to other quantum resource theories, such as quantum coherence, quantum thermodynamics, and purity. For these resource theories, we demonstrate that diluting pure quantum states into noisy ones can be advantageous for protecting the system from noise. Our results demonstrate the usefulness of quantum resource dilution, and provide a rare example for an advantage of noisy quantum states over pure states in quantum information processing.

quant-ph

Catalysis of entanglement and other quantum resources

In chemistry, a catalyst is a substance which enables a chemical reaction or increases its rate, while remaining unchanged in the process. Instead of chemical reactions, quantum catalysis enhances our ability to convert quantum states into each other under physical constraints. The nature of the constraints depends on the problem under study and can arise, e.g., from energy preservation. This article reviews the most recent developments in quantum catalysis and gives a historical overview of this research direction. We focus on the catalysis of quantum entanglement and coherence, and also discuss this phenomenon in quantum thermodynamics and general quantum resource theories. We review applications of quantum catalysis and also discuss the recent efforts on universal catalysis, where the quantum state of the catalyst does not depend on the states to be transformed. Catalytic embezzling is also considered, a phenomenon that occurs if the catalyst's state can change in the transition.

quant-ph

Entanglement catalysis for quantum states and noisy channels

Many applications of the emerging quantum technologies, such as quantum teleportation and quantum key distribution, require singlets, maximally entangled states of two quantum bits. It is thus of utmost importance to develop optimal procedures for establishing singlets between remote parties. As has been shown very recently, singlets can be obtained from other quantum states by using a quantum catalyst, an entangled quantum system which is not changed in the procedure. In this work we take this idea further, investigating properties of entanglement catalysis and its role for quantum communication. For transformations between bipartite pure states, we prove the existence of a universal catalyst, which can enable all possible transformations in this setup. We demonstrate the advantage of catalysis in asymptotic settings, going beyond the typical assumption of independent and identically distributed systems. We further develop methods to estimate the number of singlets which can be established via a noisy quantum channel when assisted by entangled catalysts. For various types of quantum channels our results lead to optimal protocols, allowing to establish the maximal number of singlets with a single use of the channel.

quant-ph

Hierarchy of correlation quantifiers comparable to negativity

Quantum systems generally exhibit different kinds of correlations. In order to compare them on equal footing, one uses the so-called distance-based approach where different types of correlations are captured by the distance to different sets of states. However, these quantifiers are usually hard to compute as their definition involves optimization aiming to find the closest states within the set. On the other hand, negativity is one of the few computable entanglement monotones, but its comparison with other correlations required further justification. Here we place negativity as part of a family of correlation measures that has a distance-based construction. We introduce a suitable distance, discuss the emerging measures and their applications, and compare them to relative entropy-based correlation quantifiers. This work is a step towards correlation measures that are simultaneously comparable and computable.

quant-ph

Cooperation and dependencies in multipartite systems

We propose an information-theoretic quantifier for the advantage gained from cooperation that captures the degree of dependency between subsystems of a global system. The quantifier is distinct from measures of multipartite correlations despite sharing many properties with them. It is directly computable for classical as well as quantum systems and reduces to comparing the respective conditional mutual information between any two subsystems. Exemplarily we show the benefits of using the new quantifier for symmetric quantum secret sharing. We also prove an inequality characterizing the lack of monotonicity of conditional mutual information under local operations and provide intuitive understanding for it. This underlines the distinction between the multipartite dependence measure introduced here and multipartite correlations.

quant-ph

Preserving quantum correlations and coherence with non-Markovianity

Open quantum systems exhibit a rich phenomenology, in comparison to closed quantum systems that evolve unitarily according to the Schrödinger equation. The dynamics of an open quantum system are typically classified into Markovian and non-Markovian, depending on whether the dynamics can be decomposed into valid quantum operations at any time scale. Since Markovian evolutions are easier to simulate, compared to non-Markovian dynamics, it is reasonable to assume that non-Markovianity can be employed for useful quantum-technological applications. Here, we demonstrate the usefulness of non-Markovianity for preserving correlations and coherence in quantum systems. For this, we consider a broad class of qubit evolutions, having a decoherence matrix separated from zero for large times. While any such Markovian evolution leads to an exponential loss of correlations, non-Markovianity can help to preserve correlations even in the limit $t \rightarrow \infty$. For covariant qubit evolutions, we also show that non-Markovianity can be used to preserve quantum coherence at all times, which is an important resource for quantum metrology. We explicitly demonstrate this effect experimentally with linear optics, by implementing the required evolution that is non-Markovian at all times.

quant-ph

Experiment-friendly formulation of quantum backflow

Quantum backflow is usually understood as a quantum interference phenomenon where probability current of a quantum particle points in the opposite direction to particle's momentum. Here, we quantify the amount of quantum backflow for arbitrary momentum distributions, paving the way towards its experimental verification. We give examples of backflow in gravitational and harmonic potential, and discuss experimental procedures required for the demonstration using atomic gravimeters. Such an experiment would show that the probability of finding a free falling particle above initial level could grow for suitably prepared quantum state with most momentum downwards.

quant-ph

Generalised uncertainty relations for angular momentum and spin in quantum geometry

We derive generalised uncertainty relations (GURs) for angular momentum and spin in the smeared-space model of quantum geometry. The model implements a minimum length and a minimum linear momentum, and recovers both the generalised uncertainty principle (GUP) and the extended uncertainty principle (EUP) within a single formalism. In this paper, we investigate the consequences of these results for particles with extrinsic and intrinsic angular momentum, and obtain generalisations of the canonical ${\rm so(3)}$ and ${\rm su(2)}$ algebras. We find that, although ${\rm SO(3)}$ symmetry is preserved on three-dimensional slices of an enlarged phase space, individual subcomponents of the generalised generators obey nontrivial subalgebras. These give rise to GURs for angular momentum while leaving the canonical commutation relations intact except for a simple rescaling, $\hbar \rightarrow \hbar + β$. The value of the new parameter, $β\simeq \hbar \times 10^{-61}$, is determined by the ratio of the dark energy density to the Planck density. Here, we assume the former to be of the order of the Planck length and the latter to be of the order of the de Sitter momentum $\sim \hbar\sqrtΛ$, where $Λ$ is the cosmological constant. In the smeared-space model, $\hbar$ and $β$ are interpreted as the quantisation scales for matter and geometry, respectively, and a quantum state vector is associated with the spatial background. We show that this also gives rise to a rescaled Lie algebra for generalised spin operators, together with associated subalgebras that are analogous to those for orbital angular momentum. Remarkably, consistency of the algebraic structure requires the quantum state associated with a flat background to be fermionic, with spin eigenvalues $\pm β/2$. Finally, the modified spin algebra leads to GURs for spin measurements.

gr-qc

Generalised uncertainty relations from superpositions of geometries

Phenomenological approaches to quantum gravity implement a minimum resolvable length-scale but do not link it to an underlying formalism describing geometric superpositions. Here, we introduce an intuitive approach in which points in the classical spatial background are delocalised, or `smeared', giving rise to an entangled superposition of geometries. The model uses additional degrees of freedom to parameterise the superposed classical backgrounds. Our formalism contains both minimum length and minimum momentum resolutions and we naturally identify the former with the Planck length. In addition, we argue that the minimum momentum is determined by the de Sitter scale, and may be identified with the effects of dark energy in the form of a cosmological constant. Within the new formalism, we obtain both the generalised uncertainty principle (GUP) and extended uncertainty principle (EUP), which may be combined to give an uncertainty relation that is symmetric in position and momentum. Crucially, our approach does not imply a significant modification of the position-momentum commutator, which remains proportional to the identity matrix. It therefore yields generalised uncertainty relations without violating the equivalence principle, in contradistinction to existing models based on nonlinear dispersion relations. Implications for cosmology and the black hole uncertainty principle correspondence are briefly discussed, and prospects for future work on the smeared-space model are outlined.

quant-ph

Entanglement gain in measurements with unknown results

We characterise non-selective global projective measurements capable of increasing quantum entanglement between two particles. We show that non-selective global projective measurements are capable of increasing entanglement between two particles, in particular, entanglement of any pure non-maximally entangled state can be improved in this way (but not of any mixed state) and we provide detailed analysis for two qubits. It is then shown that Markovian open system dynamics can only approximate such measurements, but this approximation converges exponentially fast as illustrated using Araki-Zurek model. We conclude with numerical evidence that macroscopic bodies in a random pure state do not gain entanglement in a random non-selective global measurement.

quant-ph

Extremal positive maps on $M_{3}(\mathbb{C})$ and idempotent matrices

A new method of analysing positive bistochastic maps on the algebra of complex matrices $M_{3}$ has been proposed. By identifying the set of such maps with a convex set of linear operators on $\mathbb{R}^{8}$, one can employ techniques from the theory of compact affine semigroups to obtain results concerning asymptotic properties of positive maps. It turns out that the idempotent elements play a crucial role in classifying the convex set into subsets, in which representations of extremal positive maps are to be found. It has been show that all positive bistochastic maps, extremal in the set of all positive maps of $M_{3}$, that are not Jordan isomorphisms of $M_3$ are represented by matrices that fall into two possible categories, determined by the simplest idempotent matrices: one by the zero matrix, and the other by a one dimensional orthogonal projection. Some norm conditions for matrices representing possible extremal maps have been specified and examples of maps from both categories have been brought up, based on the results published previously.

math-ph

Topology of the cone of positive maps on qubit systems

An alternative, geometrical proof of a known theorem concerning the decomposition of positive maps of the matrix algebra $M_{2}(\mathbb{C})$ has been presented. The premise of the proof is the identification of positive maps with operators preserving the Lorentz cone in four dimensions, and it allows to decompose the positive maps with respect to those preserving the boundary of the cone. In addition, useful conditions implying complete positivity of a map of $M_{2}(\mathbb{C})$ have been given, together with a sufficient condition for complete positivity of an extremal Schwarz map of $M_{n}(\mathbb{C})$. Lastly, following the same geometrical approach, a description in topological terms of maps that are simultaneously completely positive and completely copositive has been presented.

math-ph