arXiv subjects

Nils Niggemann

Publications and source records attributed to Nils Niggemann.

13 recordsLinked to original sources

arXiv2026

Gapless fracton quantum spin liquid and emergent photons in a 2D spin-1 model

Gapless fracton quantum spin liquids are exotic phases of matter described by higher-rank U(1) gauge theories which host gapped and immobile fracton matter excitations as well as gapless photons. Despite well-known field theories, no spin models beyond purely classical systems have been identified to realize these phases. Using error-controlled Green function Monte Carlo, here we investigate a square lattice spin-1 model that shows precise signatures of a fracton quantum spin liquid without indications of conventional ordering. Specifically, the magnetic response exhibits characteristic patterns of suppressed pinch points that accurately match the prediction of a rank-2 U(1) field theory and reveals the existence of emergent photon excitations in 2+1 spacetime dimensions. Remarkably, this type of fracton quantum spin liquid is not only identified in the system's ground state but also in generic low-energy sectors of a strongly fragmented Hilbert space.

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arXiv2026

Classical fracton spin liquid and Hilbert space fragmentation in a 2D spin-$1/2$ model

Classical U(1) fracton spin liquids feature an extensive ground state degeneracy and follow an effective description in terms of a tensor Gauss' law where charges, so-called fractons, have restricted mobility. Here we introduce a simple spin model that realizes such a state by straightforward discretization of the higher-rank gauge theory on a square lattice. The simplicity of this construction offers direct insights into the system's fundamental fractonic properties, such as real-space fracton configurations, height-field representation of the classical ground state manifold as well as properties of local and non-local fluctuations within the fracton-free subspace. By sampling classical Ising states from the extensive ground state manifold, we show that the effective tensor Gauss' law remains intact when explicitly enforcing the spin-1/2 length constraint, demonstrating the existence of a classical Ising fracton spin liquid. However, we observe that perturbative quantum effects are insufficient to efficiently tunnel between classical ground states, leading to severe Hilbert space fragmentation which obscures fractonic quantum behavior. Specifically, by simulating the spin-1/2 quantum model with Green function Monte Carlo as a function of the Rokhsar-Kivelson potential, we find that the system supports either magnetic long-range order or a classical spin liquid. Our findings highlight the crucial role of Hilbert-space fragmentation in fractonic spin systems but also indicate ways to mitigate such effects via increasing the spin magnitude to $S=1$, investigated in a companion paper.

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arXiv2026

Basis dependence of Neural Quantum States for the Transverse Field Ising Model

Neural Quantum States (NQS) are powerful tools used to represent complex quantum many-body states in an increasingly wide range of applications. However, despite their popularity, at present only a rudimentary understanding of their limitations exists. In this work, we investigate the dependence of NQS on the choice of the computational basis, focusing on restricted Boltzmann machines. Considering a family of rotated Hamiltonians corresponding to the paradigmatic transverse-field Ising model, we discuss the properties of ground states responsible for the dependence of NQS performance, namely the presence of ground state degeneracies as well as the uniformity of amplitudes and phases, carefully examining their interplay. We identify that the basis-dependence of the performance is linked to the convergence properties of a cluster or cumulant expansion of multi-spin operators -- providing a framework to directly connect physical, basis-dependent properties, to performance itself. Our results provide insights that may be used to gauge the applicability of NQS to new problems and to identify the optimal basis for numerical computations.

quant-ph↗

arXiv2024

Pseudo-fermion functional renormalization group for spin models

For decades, frustrated quantum magnets have been a seed for scientific progress and innovation in condensed matter. As much as the numerical tools for low-dimensional quantum magnetism have thrived and improved in recent years due to breakthroughs inspired by quantum information and quantum computation, higher-dimensional quantum magnetism can be considered as the final frontier, where strong quantum entanglement, multiple ordering channels, and manifold ways of paramagnetism culminate. At the same time, efforts in crystal synthesis have induced a significant increase in the number of tangible frustrated magnets which are generically three-dimensional in nature, creating an urgent need for quantitative theoretical modeling. We review the pseudo-fermion (PF) and pseudo-Majorana (PM) functional renormalization group (FRG) and their specific ability to address higher-dimensional frustrated quantum magnetism. First developed more than a decade ago, the PFFRG interprets a Heisenberg model Hamiltonian in terms of Abrikosov pseudofermions, which is then treated in a diagrammatic resummation scheme formulated as a renormalization group flow of $m$-particle pseudofermion vertices. The article reviews the state of the art of PFFRG and PMFRG and discusses their application to exemplary domains of frustrated magnetism, but most importantly, it makes the algorithmic and implementation details of these methods accessible to everyone. By thus lowering the entry barrier to their application, we hope that this review will contribute towards establishing PFFRG and PMFRG as the numerical methods for addressing frustrated quantum magnetism in higher spatial dimensions.

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arXiv2024

Phase diagram of the antiferromagnetic $J_1$-$J_2$ spin-$1$ pyrochlore Heisenberg model

We study the phase diagram of the antiferromagnetic $J_1$-$J_2$ Heisenberg model on the pyrochlore lattice with $S=1$ spins at zero and finite temperatures. We use a combination of complementary state-of-the-art quantum many-body approaches such as density matrix renormalization group (DMRG), density-matrix purification and pseudo-Majorana functional renormalization group (PMFRG). We present an efficient approach to preserve the applicability of the PMFRG for spin-1 systems at finite temperatures despite the inevitable presence of unphysical spin states. The good performance of our methods is first demonstrated for the nearest-neighbor pyrochlore Heisenberg model where the finite temperature behavior of the specific heat and uniform susceptibility show excellent agreement within PMFRG and density-matrix purification. Including an antiferromagnetic second neighbor coupling we find that the non-magnetic ground-state phase of the nearest neighbor model extents up to $J_2/J_1 \sim 0.02 $ within DMRG, beyond which magnetic $\boldsymbol{k}=0$ long-range order sets in. Our PMFRG calculations find the phase transition in a similar regime $J_2/J_1\sim 0.035(8)$ which, together with the DMRG result, provides a strong argument for the existence of a small but finite non-magnetic ground-state phase in the spin-1 pyrochlore Heisenberg model. We also discuss the origin of discrepancies between different versions of the functional renormalization group concerning the location of this phase transition.

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arXiv2023

Temperature flow in pseudo-Majorana functional renormalization for quantum spins

We implement the temperature flow scheme first proposed by Honerkamp and Salmhofer in Phys.~Rev.~B 64, 184516 (2001) into the pseudo-Majorana functional renormalization group method for quantum spin systems. Since the renormalization group parameter in this approach is a physical quantity -- the temperature $T$ -- the numerical efficiency increases significantly compared to more conventional renormalization group parameters, especially when computing finite temperature phase diagrams. We first apply this method to determine the finite temperature phase diagram of the $J_1$-$J_2$ Heisenberg model on the simple cubic lattice where our findings support claims of a vanishingly small nonmagnetic phase around the high frustration point $J_2=0.25J_1$. Perhaps most importantly, we find the temperature flow scheme to be advantageous in detecting finite temperature phase transitions as, by construction, a phase transition is never encountered at an artificial, unphysical cutoff parameter. Finally, we apply the temperature flow scheme to the dipolar XXZ model on the square lattice where we find a rich phase diagram with a large non-magnetic regime down to the lowest accessible temperatures. Wherever a comparison with error-controlled (quantum) Monte Carlo methods is applicable, we find excellent quantitative agreement with less than $5\%$ deviation from the numerically exact results.

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arXiv2023

$\require{mhchem}$Quantum paramagnetism in the decorated square-kagome antiferromagnet $\ce{Na6Cu7BiO4(PO4)4Cl3}$

$\require{mhchem}$The square-kagome lattice Heisenberg antiferromagnet is a highly frustrated Hamiltonian whose material realizations have been scarce. We theoretically investigate the recently synthesized $\ce{Na6Cu7BiO4(PO4)4Cl3}$ where a Cu$^{2+}$ spin-$1/2$ square-kagome lattice (with six site unit cell) is decorated by a seventh magnetic site alternatingly above and below the layers. The material does not show any sign of long-range magnetic order down to 50 mK despite a Curie-Weiss temperature of $-212$ K indicating a quantum paramagnetic phase. Our DFT energy mapping elicits a purely antiferromagnetic Hamiltonian that features longer range exchange interactions beyond the pure square-kagome model and, importantly, we find the seventh site to be strongly coupled to the plane. We combine two variational Monte Carlo approaches, pseudo-fermion/Majorana functional renormalization group and Schwinger-Boson mean field calculations to show that the complex Hamiltonian of $\ce{Na6Cu7BiO4(PO4)4Cl3}$ still features a nonmagnetic ground state. We explain how the seventh Cu$^{2+}$ site actually aids the stabilization of the disordered state. We predict static and dynamic spin structure factors to guide future neutron scattering experiments.

cond-mat.str-el↗

arXiv2023

Quantum effects on unconventional pinch point singularities

Fracton phases are a particularly exotic type of quantum spin liquids where the elementary quasiparticles are intrinsically immobile. These phases may be described by unconventional gauge theories known as tensor or multipolar gauge theories, characteristic for so-called type-I or type-II fracton phases, respectively. Both variants have been associated with distinctive singular patterns in the spin structure factor, such as multifold pinch points for type-I and quadratic pinch points for type-II fracton phases. Here, we assess the impact of quantum fluctuations on these patterns by numerically investigating the spin $S=1/2$ quantum version of a classical spin model on the octahedral lattice featuring exact realizations of multifold and quadratic pinch points, as well as an unusual pinch line singularity. Based on large scale pseudo fermion and pseudo Majorana functional renormalization group calculations, we take the intactness of these spectroscopic signatures as a measure for the stability of the corresponding fracton phases. We find that in all three cases, quantum fluctuations significantly modify the shape of pinch points or lines by smearing them out and shifting signal away from the singularities in contrast to effects of pure thermal fluctuations. This indicates possible fragility of these phases and allows us to identify characteristic fingerprints of their remnants.

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arXiv2022

Pinch-points to half-moons and up in the stars: the kagome skymap

Pinch point singularities, associated with flat band magnetic excitations, are tell-tale signatures of Coulomb spin liquids. While their properties in the presence of quantum fluctuations have been widely studied, the fate of the complementary non-analytic features -- shaped as half-moons and stars -- arising from adjacent shallow dispersive bands has remained unexplored. Here, we address this question for the spin $S=1/2$ Heisenberg antiferromagnet on the kagome lattice with second and third neighbor couplings, which allows one to tune the classical ground state from flat bands to being governed by shallow dispersive bands for intermediate coupling strengths. Employing the complementary strengths of variational Monte Carlo, pseudo-fermion functional renormalization group, and density-matrix renormalization group, we establish the quantum phase diagram. The U(1) Dirac spin liquid ground state of the nearest-neighbor antiferromagnet remains remarkably robust till intermediate coupling strengths when it transitions into a pinwheel valence bond crystal displaying signatures of half-moons in its structure factor. Our work thus identifies a microscopic setting that realizes one of the proximate orders of the Dirac spin liquid identified in a recent work [Song, Wang, Vishwanath, He, Nat. Commun. 10, 4254 (2019)]. For larger couplings, we obtain a collinear magnetically ordered ground state characterized by star-like patterns.

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arXiv2022

Quantitative functional renormalization for three-dimensional quantum Heisenberg models

We employ a recently developed variant of the functional renormalization group method for spin systems, the so-called pseudo Majorana functional renormalization group, to investigate three-dimensional spin-1/2 Heisenberg models at finite temperatures. We study unfrustrated and frustrated Heisenberg systems on the simple cubic and pyrochlore lattices. Comparing our results with other quantum many-body techniques, we demonstrate a high quantitative accuracy of our method. Particularly, for the unfrustrated simple cubic lattice antiferromagnet ordering temperatures obtained from finite-size scaling of one-loop data deviate from error controlled quantum Monte Carlo results by $\sim5\%$ and we further confirm the established values for the critical exponent $ν$ and the anomalous dimension $η$. As the PMFRG yields results in good agreement with QMC, but remains applicable when the system is frustrated, we next treat the pyrochlore Heisenberg antiferromagnet as a paradigmatic magnetically disordered system and find nearly perfect agreement of our two-loop static homogeneous susceptibility with other methods. We further investigate the broadening of pinch points in the spin structure factor as a result of quantum and thermal fluctuations and confirm a finite width in the extrapolated limit $T\rightarrow0$. While extensions towards higher loop orders $\ell$ seem to systematically improve our approach for magnetically disordered systems we also discuss subtleties when increasing $\ell$ in the presence of magnetic order. Overall, the pseudo Majorana functional renormalization group is established as a powerful many-body technique in quantum magnetism with a wealth of possible future applications.

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arXiv2021

Pinwheel valence-bond-crystal ground state of the spin-$\frac{1}{2}$ Heisenberg antiferromagnet on the $shuriken$ lattice

We investigate the nature of the ground-state of the spin-$\frac{1}{2}$ Heisenberg antiferromagnet on the $shuriken$ lattice by complementary state-of-the-art numerical techniques, such as variational Monte Carlo (VMC) with versatile Gutzwiller-projected Jastrow wave functions, unconstrained multi-variable variational Monte Carlo (mVMC), and pseudo-fermion/Majorana functional renormalization group (PF/PM-FRG) methods. We establish the presence of a quantum paramagnetic ground state and investigate its nature, by classifying symmetric and chiral quantum spin liquids, and inspecting their instabilities towards competing valence-bond-crystal (VBC) orders. Our VMC analysis reveals that a VBC with a pinwheel structure emerges as the lowest-energy variational ground state, and it is obtained as an instability of the U(1) Dirac spin liquid. Analogous conclusions are drawn from mVMC calculations employing accurate BCS pairing states supplemented by symmetry projectors, which confirm the presence of pinwheel VBC order by a thorough analysis of dimer-dimer correlation functions. Our work highlights the nontrivial role of quantum fluctuations via the Gutzwiller projector in resolving the subtle interplay between competing orders.

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arXiv2021

Frustrated Quantum Spins at finite Temperature: Pseudo-Majorana functional RG approach

The pseudofermion functional renormalization group (PFFRG) method has proven to be a powerful numerical approach to treat frustrated quantum spin systems. In its usual implementation, however, the complex fermionic representation of spin operators introduces unphysical Hilbert space sectors which renders an application at finite temperatures inaccurate. In this work, we formulate a general functional renormalization group approach based on Majorana fermions to overcome these difficulties. We, particularly, implement spin operators via an $SO(3)$ symmetric Majorana representation which does not introduce any unphysical states and, hence, remains applicable to quantum spin models at finite temperatures. We apply this scheme, dubbed pseudo Majorana functional renormalization group (PMFRG) method, to frustrated Heisenberg models on small spin clusters as well as square and triangular lattices. Computing the finite temperature behavior of spin correlations and thermodynamic quantities such as free energy and heat capacity, we find good agreement with exact diagonalization and the high-temperature series expansion down to moderate temperatures. We, particularly, observe a significantly enhanced accuracy of the PMFRG compared to the PFFRG at finite temperatures. More generally, we conclude that the development of functional renormalization group approaches with Majorana fermions considerably extends the scope of applicability of such methods.

cond-mat.str-el↗

arXiv2019

Classical spiral spin liquids as a possible route to quantum spin liquids

Quantum spin liquids are long-range entangled phases whose magnetic correlations are determined by strong quantum fluctuations. While an overarching principle specifying the precise microscopic coupling scenarios for which quantum spin-liquid behavior arises is unknown, it is well-established that they are preferably found in spin systems where the corresponding classical limit of spin magnitudes $S\rightarrow\infty$ exhibits a macroscopic ground state degeneracy, so-called classical spin liquids. Spiral spin liquids represent a special family of classical spin liquids where degenerate manifolds of spin spirals form closed contours or surfaces in momentum space. Here, we investigate the potential of spiral spin liquids to evoke quantum spin-liquid behavior when the spin magnitude is tuned from the classical $S\rightarrow\infty$ limit to the quantum $S=1/2$ case. To this end, we first use the Luttinger-Tisza method to formulate a general scheme which allows one to construct new spiral spin liquids based on bipartite lattices. We apply this approach to the two-dimensional square lattice and the three-dimensional hcp lattice to design classical spiral spin-liquid phases which have not been previously studied. By employing the pseudofermion functional renormalization group (PFFRG) technique we investigate the effects of quantum fluctuations when the classical spins are replaced by quantum $S=1/2$ spins. We indeed find that extended spiral spin-liquid regimes change into paramagnetic quantum phases possibly realizing quantum spin liquids. Remnants of the degenerate spiral surfaces are still discernible in the momentum-resolved susceptibility, even in the quantum $S=1/2$ case. In total, this corroborates the potential of classical spiral spin liquids to induce more complex non-magnetic quantum phases.

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