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Stability of Topological States and Crystalline Solids

Bartholomew Andrews

Published Oct 23, 2018• 3 citations
Publisher

Abstract

From the alignment of magnets to the melting of ice, the transition between different phases of matter underpins our exploitation of materials. Both a quantum and a classical phase can undergo an instability into another state. In this thesis, we study the stability of matter in both contexts: topological states and crystalline solids. We start with the stability of fractional quantum Hall states on a lattice, known as fractional Chern insulators. We investigate, using exact diagonalization, fractional Chern insulators in higher Chern bands of the Harper-Hofstadter model, and examine the robustness of their many-body energy gap in the effective continuum limit. We report evidence of stable states in this regime; comment on two cases associated with a bosonic integer quantum Hall effect; and find a modulation of the correlation function in higher Chern bands. We next examine the stability of molecules using variational and diffusion Monte Carlo. By incorporating the matrix of force constants directly into the algorithms, we find that we are able to improve the efficiency and accuracy of atomic relaxation and eigenfrequency calculation. We test the performance on a diverse selection of case studies, with varying symmetries and mass distributions, and show that the proposed formalism outperforms existing restricted Hartree-Fock and density functional theory methods. Finally, we analyze the stability of three-dimensional crystals. We note that for repulsive Coulomb crystals of point nuclei, cubic systems have a zero matrix of force constants at second order. We investigate this by constructing an analytical model in the tight-binding approximation, and present a phase diagram of the most stable crystal structures, as we tune core and valence orbital radii. We reconcile our results with calculations in the nearly free electron regime, as well as current research in condensed matter and plasma physics.

DOI
10.17863/cam.36140

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The concept of non-trivial electronic topology in condensed matter physics is crucial for understanding the electronic spectrum of solids and for tailoring various thermodynamic and transport properties, useful for real-world applications. Research on topological insulators and superconductors primarily utilizes the electronic band theory and symmetry classes of gapped quantum systems, with the existence of spectral or mobility gaps ensured even in the presence of impurities and defects. However, structural disorder, naturally manifested in materials such as glasses and amorphous solids, can significantly impact the critical properties of phase transitions in topological quantum matters. This dissertation systematically studies topological phase transitions in non-crystalline free-fermion systems via tight-binding quantum Hamiltonians on 2D random geometries. Leveraging various theoretical and experimentally accessible measures, we demonstrate the resilience of topological phases in non-crystalline systems against structural randomness, described by classical percolation theory, and characterize their unique critical behavior through finite-size scaling. We also extend the notion of amorphous topological states to non-integer dimensional random systems. We reveal that these 2D-embedded random fractals can admit well-defined thermodynamic topological phases with unconventional critical properties. We further study quantum dynamics in these random topological systems. By employing a family of discrete-time topological quantum walks on random percolation lattices, we address wavefunction propagation, superdiffusive quantum speedup, and localization transition by identifying the critical probabilities and timescales. Lastly, we introduce topological lattices with adjustable spatial correlation to investigate Landau levels and quantum oscillations in a low magnetic field regime.

•Jan 1, 2023•0 citations
From the alignment of magnets to the melting of ice, the transition between different phases of matter underpins our exploitation of materials. Both a quantum and a classical phase can undergo an instability into another state. In this thesis, we study the stability of matter in both contexts: topological states and crystalline solids. We start with the stability of fractional quantum Hall states on a lattice, known as fractional Chern insulators. We investigate, using exact diagonalization, fractional Chern insulators in higher Chern bands of the Harper-Hofstadter model, and examine the robustness of their many-body energy gap in the effective continuum limit. We report evidence of stable states in this regime; comment on two cases associated with a bosonic integer quantum Hall effect; and find a modulation of the correlation function in higher Chern bands. We next examine the stability of molecules using variational and diffusion Monte Carlo. By incorporating the matrix of force constants directly into the algorithms, we find that we are able to improve the efficiency and accuracy of atomic relaxation and eigenfrequency calculation. We test the performance on a diverse selection of case studies, with varying symmetries and mass distributions, and show that the proposed formalism outperforms existing restricted Hartree-Fock and density functional theory methods. Finally, we analyze the stability of three-dimensional crystals. We note that for repulsive Coulomb crystals of point nuclei, cubic systems have a zero matrix of force constants at second order. We investigate this by constructing an analytical model in the tight-binding approximation, and present a phase diagram of the most stable crystal structures, as we tune core and valence orbital radii. We reconcile our results with calculations in the nearly free electron regime, as well as current research in condensed matter and plasma physics.
The Hofstadter model is a popular choice for theorists investigating the fractional quantum Hall effect on lattices, due to its simplicity, infinite selection of topological flat bands, and increasing applicability to real materials. In particular, fractional Chern insulators in bands with Chern number ∣C∣>1|C|>1∣C∣>1 can demonstrate richer physical properties than continuum Landau level states and have recently been detected in experiments. Motivated by this, we examine the stability of fractional Chern insulators with higher Chern number in the Hofstadter model, using large-scale infinite density matrix renormalization group (iDMRG) simulations on a thin cylinder. We confirm the existence of fractional states in bands with Chern numbers C=1,2,3,4,5C=1,2,3,4,5C=1,2,3,4,5 at the filling fractions predicted by the generalized Jain series [Phys. Rev. Lett. 115, 126401 (2015)]. Moreover, we discuss their metal-to-insulator phase transitions, as well as the subtleties in distinguishing between physical and numerical stability. Finally, we comment on the relative suitability of fractional Chern insulators in higher Chern number bands for proposed modern applications.
Crystalline symmetries give rise to topological invariants that can distinguish quantum phases of matter. Understanding these in strongly interacting systems is an ongoing research direction requiring non-perturbative methods. Recent developments have demonstrated that even classic models, like the Harper-Hofstadter model of free fermions on a lattice in a magnetic field, yield a host of crystalline symmetry protected topological invariants. Here we review some of these developments, focusing mainly on how to characterize, classify, and detect invariants arising from lattice translation and rotation symmetries along with charge conservation in two-dimensional systems, including integer and fractional Chern insulators.
We develop a conditionally closed theoretical architecture for condensed-matter and solid-state physics from three physical axioms: microscopic ontic definiteness and finite localization, the physical reality of the spacetime-vacuum substrate, and persistent causal source–response coupling. Electrons, nuclei, atoms, and molecular units enter as finite topological carriers, whereas crystals, energy bands, phonons, quasiparticles, order parameters, defects, and topological phases are derived as spectral, variational, statistical, or homotopy properties of the resulting many-body system. We construct a sorted first-order language, a model-theoretic conservative extension of the underlying physical theory, and a constrained Legendre descent from a unified matter–substrate action to a self-adjoint, lower-bounded many-body Hamiltonian. A signed ownership ledger prevents double counting among self-energy, screening, correlation, electron–phonon, electromagnetic, historical-memory, and environmental contributions. For neutral stable branches, we establish a thermodynamic limit under translation covariance, two-sided almost-additivity, controlled Coulomb surface terms, and passive auxiliary realizations of causal memory. The framework derives crystal symmetry, Bloch and Wannier representations, lattice dynamics, phonon quantization, electronic bands, semiconductor statistics, Green functions, conserving Kadanoff–Baym dynamics, strong-correlation reductions, magnetism, polarons, superconductivity, disorder, localization, transport, critical phenomena, dielectric response, defects, interfaces, and low-dimensional systems. Conventional Bloch, tight-binding, nearly-free-electron, Debye, Landau, Fermi-liquid, Hubbard, Heisenberg, BCS/BdG, Boltzmann, and Kubo theories are recovered only as controlled limits with explicit validity domains and failure conditions. Fundamental-carrier topology, band topology, and interacting many-body topology are distinguished rigorously. Stability criteria are given for spectral and mobility gaps, Green-function invariants, Floquet and non-Hermitian phases, completely positive open dynamics, Liouvillian steady-state bundles, and finite-memory auxiliary systems. We also specify when thermodynamic, zero-frequency, zero-wave-number, long-time, symmetry-breaking, and regulator limits commute and when their ordering defines distinct physical observables. A terminal completion theorem identifies the conditions for pure-theory closure: semantic conservativity, action traceability, self-adjoint lower-bounded dynamics, thermodynamic-limit control, causality, positivity, conservation laws, controlled standard limits, valid topological domains, and falsifiable observable maps. This theoretical closure does not imply that the spectrum, phase diagram, or transport coefficients of any particular material have been calculated or experimentally confirmed; such tasks belong to separate material-application programs. Keywords **global realism; topological condensed matter; solid-state physics; many-body theory; causal memory; historical disturbance field; Green functions; strong correlations; superconductivity; topological phases; quantum transport; thermodynamic limit; open quantum systems; Liouvillian topology; controlled effective theories**
We study how the stability of the fractional quantum Hall effect is influenced by the geometry of band structure in lattice Chern insulators. We consider the Hofstadter model, which converges to continuum Landau levels in the limit of small flux per plaquette. This gives us a degree of analytic control not possible in generic lattice models, and we are able to obtain analytic expressions for the relevant geometric criteria. These may be differentiated by whether they converge exponentially or polynomially to the continuum limit. We demonstrate that the latter criteria play a dominant role in predicting the physics of interacting particles in Hofstadter bands in this low flux density regime. In particular, we show that the many-body gap depends monotonically on a band-geometric criterion related to the trace of the Fubini-Study metric.
We study how the stability of the fractional quantum Hall effect is influenced by the geometry of band structure in lattice Chern insulators. We consider the Hofstadter model, which converges to continuum Landau levels in the limit of small flux per plaquette. This gives us a degree of analytic control not possible in generic lattice models, and we are able to obtain analytic expressions for the relevant geometric criteria. These may be differentiated by whether they converge exponentially or polynomially to the continuum limit. We demonstrate that the latter criteria play a dominant role in predicting the physics of interacting particles in Hofstadter bands in this low flux density regime. In particular, we show that the many-body gap depends monotonically on a band-geometric criterion related to the trace of the Fubini-Study metric.
The concept of non-trivial electronic topology in condensed matter physics is crucial for understanding the electronic spectrum of solids and for tailoring various thermodynamic and transport properties, useful for real-world applications. Research on topological insulators and superconductors primarily utilizes the electronic band theory and symmetry classes of gapped quantum systems, with the existence of spectral or mobility gaps ensured even in the presence of impurities and defects. However, structural disorder, naturally manifested in materials such as glasses and amorphous solids, can significantly impact the critical properties of phase transitions in topological quantum matters. This dissertation systematically studies topological phase transitions in non-crystalline free-fermion systems via tight-binding quantum Hamiltonians on 2D random geometries. Leveraging various theoretical and experimentally accessible measures, we demonstrate the resilience of topological phases in non-crystalline systems against structural randomness, described by classical percolation theory, and characterize their unique critical behavior through finite-size scaling. We also extend the notion of amorphous topological states to non-integer dimensional random systems. We reveal that these 2D-embedded random fractals can admit well-defined thermodynamic topological phases with unconventional critical properties. We further study quantum dynamics in these random topological systems. By employing a family of discrete-time topological quantum walks on random percolation lattices, we address wavefunction propagation, superdiffusive quantum speedup, and localization transition by identifying the critical probabilities and timescales. Lastly, we introduce topological lattices with adjustable spatial correlation to investigate Landau levels and quantum oscillations in a low magnetic field regime.