The vicinity of continuous quantum phase transitions displays unique properties such as scaling behavior and incoherent excitation spectra which are not found in any stable phase of matter. This fascinating quantum critical regime is crucial for progress on key problems of modern condensed matter physics. The three research projects of this thesis challenge and refine our understanding of quantum criticality in different ways. Part I concerns unexpected quantum critical behavior near the Mott transition. The bandwidth-controlled Mott transition in the half-filled one-band Hubbard model is one of the most paradigmatic phenomena of strongly correlated physics. Within the approximation of dynamical mean-field theory (DMFT) this metal-insulator transition is of first order at low temperatures, with the transition line ending at a critical temperature. Surprisingly, numerical calculations with DMFT and experiments in organic salts consistently found quantum critical scaling of the resistivity above the critical temperature. The aim of this project is to explain this unexpected scaling in the absence of a quantum critical point in the phase diagram. To this end, we perform extensive DMFT simulations with the numerical renormalization group as a state-of-the-art impurity solver. We find that the quantum critical scaling can be traced back to the metastable insulator at the boundary of the coexistence region at T = 0 which exhibits previously unknown scale-invariance on the frequency axis. In Part II we study how magnetic quantum criticality is affected by the coupling to additional non-critical degrees of freedom. Considering typical electronic energy scales the study of quantum critical phenomena in magnets requires very low temperatures in the sub-100mK range. In this regime additional effects which are typically neglected in the theoretical modeling may become important. Here we focus on one particular example, which is the hyperfine coupling to nuclear spins. We investigate the fate of the quantum critical behavior at lowest temperatures and determine crossover scales below which a purely electronic description is no longer sufficient. Explicit calculations for paradigmatic models on the level of mean-field theory plus Gaussian fluctuations reveal that the quantum phase transition can be shifted or smeared in the presence of nuclear spins. More exotic effects of nuclear spins, e.g. in spin liquids, are discussed on a qualitative level. Part III is devoted to the discussion of domain-driven phase transitions in easy-axis ferromagnets.This work is motivated by an experimental study of LiHoF4, a dipolar easy-axis ferromagnet that displays a well-studied quantum phase transition from a ferromagnetic to a paramagnetic phase as function of a transverse field. Measurements of the ac susceptibility found a well-defined phase transition even in tilted fields where the Ising symmetry is explicitly broken and Landau theory of the microscopic order parameter predicts a crossover. We are able to explain and model the transition in tilted fields by the inclusion of domain effects, i.e., by taking into account the spontaneous breaking of translational symmetry by mesoscale pattern formation in the ferromagnetic phase. The modeling of stray-field energies as effective antiferromagnetic couplings between magnetization components in different domains is in excellent quantitative agreement with the experimental results.:1 Phases and their transitions . . . . . . . . . . . . . . . . . . . . 4 1.1 Thermal and quantum phase transitions . . . . . . . . . . . . . . . . . . . . 4 1.2 Theoretical description of phase transitions . . . . . . . . . . . . . . . . . . 8 1.3 Project overview . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 13 I Mott quantum criticality in the one-band Hubbard model . . . . . . . . . . .15 2 Introduction to the Mott transition . . . . . . . . . . . . . . . . . . . . 16 2.1 Metal-insulator transitions and the Hubbard model . . . . . . . . . . . . . . 16 2.2 A local perspective: the idea of dynamical mean-field theory . . . . . . . . . 19 2.3 Quantum critical scaling near the Mott transition . . . . . . . . . . . . . . . 21 3 Dynamical mean-field theory (DMFT) . . . . . . . . . . . . . . . . . . . . 25 3.1 Single-impurity Anderson model . . . . . . . . . . . . . . . . . . . . . . . . 25 3.2 Theoretical foundations of DMFT . . . . . . . . . . . . . . . . . . . . . . . 28 3.3 Wilson's numerical renormalization group . . . . . . . . . . . . . . . . . . . 32 3.4 Implementation and choice of parameters . . . . . . . . . . . . . . . . . . . 36 4 Power-law spectra and quantum critical scaling . . . . . . . . . . . . . . . . . . 38 4.1 Scale-invariant solutions of DMFT . . . . . . . . . . . . . . . . . . . . . . . 38 4.2 Spectral power laws at T=0 in the metastable insulator . . . . . . . . . . . 40 4.3 Finite-temperature crossovers in the spectral function . . . . . . . . . . . . 47 4.4 Resistivity scaling driven by spectral power laws . . . . . . . . . . . . . . . 50 4.5 Scaling analysis of the dynamic susceptibility . . . . . . . . . . . . . . . . . 58 4.6 Ideas and obstacles towards an analytical understanding . . . . . . . . . . . 62 4.7 Conclusions and outlook . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 63 II Limits on magnetic quantum criticality from nuclear spins . . . . . . . . . . . . .65 5 Stability of magnetic transitions to hyperfine coupling . . . . . . . . . . . . . . . .66 5.1 Nuclear spins near quantum criticality . . . . . . . . . . . . . . . . . . . . . 66 5.2 Introduction to nuclear spins and hyperfine coupling . . . . . . . . . . . . . 67 5.3 Magnetic phases in the presence of nuclear spins . . . . . . . . . . . . . . . 69 5.4 Two scenarios for magnetic quantum criticality plus nuclear spins . . . . . . 70 6 Paradigmatic models for magnetic quantum phase transitions . . . . . . . . . 73 6.1 Transverse-field Ising model . . . . . . . . . . . . . . . . . . . . . . . . . . . 73 6.2 Coupled-dimer model . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 76 6.3 Frustrated spin models . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 80 7 Crossover scales introduced by nuclear spins . . . . . . . . . . . . . . . . . . .83 7.1 Shifted transitions: transverse-field Ising magnets . . . . . . . . . . . . . . . 83 7.2 Smeared transitions: coupled-dimer magnets . . . . . . . . . . . . . . . . . . 90 7.3 Additional transitions due to nuclear spins . . . . . . . . . . . . . . . . . . . 98 7.4 Exotic magnetic quantum phase transitions plus nuclear spins . . . . . . . . 101 7.5 Conclusions and outlook . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 102 III Domain-driven phase transitions in easy-axis ferromagnets . . . . . . . . 105 8 Easy-axis ferromagnet LiHoF4 . . . . . . . . . . . . . . . . . . . . 106 8.1 Easy-axis ferromagnets in tilted fields . . . . . . . . . . . . . . . . . . . . . 106 8.2 LiHoF4 and its phase transitions . . . . . . . . . . . . . . . . . . . . . . . . 109 9 Modeling of microscopic degrees of freedom in LiHoF4 . . . . . . . . . . . . 112 9.1 Landau theory in tilted fields . . . . . . . . . . . . . . . . . . . . . . . . . . 112 9.2 Crystal field effects and microscopic Hamiltonian . . . . . . . . . . . . . . . 113 9.3 Crossovers in the microscopic model . . . . . . . . . . . . . . . . . . . . . . 118 10 Modeling of mesoscopic degrees of freedom in LiHoF4 . . . . . . . . . . . . . . .123 10.1 Domains in ferromagnets . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 123 10.2 Modeling of domain effects as effective interactions . . . . . . . . . . . . . . 127 10.3 Combined mean-field Hamiltonian and domain optimization . . . . . . . . . 130 10.4 Nature of the phase transition in tilted fields . . . . . . . . . . . . . . . . . 132 10.5 Domain-driven phase transition at T = 0 . . . . . . . . . . . . . . . . . . . . 135 10.6 Domain-driven phase transition at finite temperatures . . . . . . . . . . . . 141 10.7 Comparison with experimental results . . . . . . . . . . . . . . . . . . . . . 146 10.8 Conclusions and outlook . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 149 IV Summary & Outlook . . . . . . . . . . . . . . . . . . . . 151 V Appendices . . . . . . . . . . . . . . . . . . . . 155 A Part I: NRG level spectra . . . . . . . . . . . . . . . . . . . . 156 B Part I: Analytical properties of scale-invariant DMFT solutions . . . . . . . . . . .159 B.1 Kondo perturbation theory as an impurity solver . . . . . . . . . . . . . . . 159 B.2 Analytical properties of a power-law self-energy . . . . . . . . . . . . . . . . 166 C Part I: Scaling analysis of the resistivity . . . . . . . . . . . . . . . . . . 168 D Part II: Solution of the transverse-field Ising model with nuclear spins . . . . . . 172 D.1 Holstein-Primakoff representation of the electronic and nuclear spins . . . . 172 D.2 Determination of the classical reference state . . . . . . . . . . . . . . . . . 174 D.3 Excitation spectrum of the coupled nuclear-electronic model . . . . . . . . . 175 D.4 Magnetization, susceptibility, and heat capacity . . . . . . . . . . . . . . . . 177 E Part II: Solution of the coupled-dimer model with nuclear spins . . . . . . . . . . . 181 E.1 Bond-operator description of the electronic spins . . . . . . . . . . . . . . . 181 E.2 Determination to the electronic ground state . . . . . . . . . . . . . . . . . 185 E.3 Holstein-Primakoff representation of the nuclear spins . . . . . . . . . . . . 188 E.4 Excitation spectrum of the coupled nuclear-electronic model . . . . . . . . . 189 E.5 Staggered magnetization and susceptibility . . . . . . . . . . . . . . . . . . 192 F Part III: Calculation of domain-induced effective interactions . . . . . . . . . . . . . 198 Bibliography . . . . . . . . . . . . . . . . . . . . 203

In this thesis I investigate several aspects of local quantum criticality, a concept of key importance in a number of physical contexts ranging from critical heavy fermion compounds to quantum dot systems. Quantum critical points are associated with second order phase transitions at zero temperature. In contrast to their finite-temperature counterparts, the zero-point motion cannot be neglected near a quantum critical point. As a result, the incorporation of quantum dynamics leads to an effective dimension larger than the spatial dimension of the system for the order parameter fluctuations within the Ginzburg-Landau-Wilson treatment of criticality. This so-called quantum-to-classical mapping works well for the critical properties in insulating systems but apparently fails in systems containing gapless fermions. This has been experimentally most clearly been demonstrated within a particular class of intermetallic compounds called heavy fermions. A particular way in which the Ginzburg-Landau-Wilson paradigm fails is for critical Kondo destruction that seems to underlie the unconventional quantum criticality seen in the heavy fermions. I focus on studying the properties of critical Kondo destruction and the emergence of energy-over-temperature-scaling in systems without spatial degrees of freedom, i.e., so-called quantum impurity systems. In particular, I employ large-N techniques to address critical properties of this class of quantum phase transitions in and out of equilibrium. As quantum critical systems are characterized by a scale-invariant spectrum with many low-lying excitations, it may appear that any perturbation can lead to a response beyond the linear response regime. Understanding what governs the non-linear response regime near quantum criticality is an interesting area. Here, I first present a path integral version of the Schrieffer-Wolff transformation which relates the functional integral form of the partition function of the Anderson model to that of its effective low-energy model. The equivalence between the low-energy sector of the Anderson model in the Kondo regime and the spin-isotropic Kondo model is usually established via a canonical transformation performed on the Hamiltonian, followed by a projection. The resulting functional integral assumes the form of a spin path integral and includes a geometric phase factor, i.e. a Berry phase. The approach stresses the underlying symmetries of the model and allows for a straightforward generalization of the transformation to more involved models. As an example of the efficiency of the approach I apply it to a single electron transistor attached to ferromagnetic leads and derive the effective low-energy model of such a magnetic transistor. As Kondo screening is a local phenomenon, it and its criticality can be studied using the appropriate impurity model. A general impurity model to study critical Kondo destruction is the pseudogap Bose-Fermi Kondo model. Here, I concentrate on the multi-channel version of the model using the dynamical large-N study. This model allows to study the non-trivial interplay between two different mechanisms of critical Kondo destruction. The interplay of two processes that can each by itself lead to critical Kondo destruction. The zero-temperature residual entropy at various fixed points for the model is also discussed. The two channel Anderson model exhibits several continuous quantum phase transitions between weak- and strong-coupling phases. The non-crossing approximation (NCA) is believed to give reliable results for the standard two-channel Anderson model of a magnetic impurity in a metal. I revisit the reliability of the NCA for the standard two channel Anderson model (constant conduction electron density of states) and investigate its reliability for the two-channel pseudogap Anderson model. This is done by comparing finite-temperature, finite-frequency solutions of the NCA equations and asymptotically exact zero-temperature NCA solutions with numerical renormalization-group calculations. The phase diagram of this model is well established. The focus here will be on the dynamical scaling properties obtained within the NCA. Finally, I study the thermal and non-thermal steady state scaling functions and the steady-state dynamics of the pseudogap Kondo model. This model allows us to study the concept of effective temperatures near fully interacting as well as weak-coupling fixed points and compare the out-of-equilibrium scaling properties of critical Kondo destruction to those of the traditional spin-density wave (SDW) scenario. The differences I identify can be experimentally probed. This may be helpful in identifying the nature of the quantum critical points observed in certain heavy fermion compounds.

This thesis contains four studies of the effects of disorder and randomness on strongly correlated quantum phases of matter. Starting with an itinerant ferromagnet, I first use an order-by-disorder approach to show that adding quenched charged disorder to the model generates new quantum fluctuations in the vicinity of the quantum critical point which lead to the formation of a novel magnetic phase known as a helical glass. Switching to bosons, I then employ a momentum-shell renormalisation group analysis of disordered lattice gases of bosons where I show that disorder breaks ergodicity in a non-trivial way, leading to unexpected glassy freezing effects. This work was carried out in the context of ultracold atomic gases, however the same physics can be realised in dimerised quantum antiferromagnets. By mapping the antiferromagnetic model onto a hard-core lattice gas of bosons, I go on to show the importance of the non-ergodic effects to the thermodynamics of the model and find evidence for an unusual glassy phase known as a Mott glass not previously thought to exist in this model. Finally, I use a mean-field numerical approach to simulate current generation quantum gas microscopes and demonstrate the feasibility of a novel measurement scheme designed to measure the Edwards-Anderson order parameter, a quantity which describes the degree of ergodicity breaking and which has never before been experimentally measured in any strongly correlated quantum system. Together, these works show that the addition of disorder into strongly interacting quantum systems can lead to qualitatively new behaviour, triggering the formation of new phases and new physics, rather than simply leading to small quantitative changes to the physics of the clean system. They provide new insights into the underlying physics of the models and make direct connection with experimental systems which can be used to test the results presented here.

In this thesis I investigate several aspects of local quantum criticality, a concept of key importance in a number of physical contexts ranging from critical heavy fermion compounds to quantum dot systems. Quantum critical points are associated with second order phase transitions at zero temperature. In contrast to their finite-temperature counterparts, the zero-point motion cannot be neglected near a quantum critical point. As a result, the incorporation of quantum dynamics leads to an effective dimension larger than the spatial dimension of the system for the order parameter fluctuations within the Ginzburg-Landau-Wilson treatment of criticality. This so-called quantum-to-classical mapping works well for the critical properties in insulating systems but apparently fails in systems containing gapless fermions. This has been experimentally most clearly been demonstrated within a particular class of intermetallic compounds called heavy fermions. A particular way in which the Ginzburg-Landau-Wilson paradigm fails is for critical Kondo destruction that seems to underlie the unconventional quantum criticality seen in the heavy fermions. I focus on studying the properties of critical Kondo destruction and the emergence of energy-over-temperature-scaling in systems without spatial degrees of freedom, i.e., so-called quantum impurity systems. In particular, I employ large-N techniques to address critical properties of this class of quantum phase transitions in and out of equilibrium. As quantum critical systems are characterized by a scale-invariant spectrum with many low-lying excitations, it may appear that any perturbation can lead to a response beyond the linear response regime. Understanding what governs the non-linear response regime near quantum criticality is an interesting area. Here, I first present a path integral version of the Schrieffer-Wolff transformation which relates the functional integral form of the partition function of the Anderson model to that of its effective low-energy model. The equivalence between the low-energy sector of the Anderson model in the Kondo regime and the spin-isotropic Kondo model is usually established via a canonical transformation performed on the Hamiltonian, followed by a projection. The resulting functional integral assumes the form of a spin path integral and includes a geometric phase factor, i.e. a Berry phase. The approach stresses the underlying symmetries of the model and allows for a straightforward generalization of the transformation to more involved models. As an example of the efficiency of the approach I apply it to a single electron transistor attached to ferromagnetic leads and derive the effective low-energy model of such a magnetic transistor. As Kondo screening is a local phenomenon, it and its criticality can be studied using the appropriate impurity model. A general impurity model to study critical Kondo destruction is the pseudogap Bose-Fermi Kondo model. Here, I concentrate on the multi-channel version of the model using the dynamical large-N study. This model allows to study the non-trivial interplay between two different mechanisms of critical Kondo destruction. The interplay of two processes that can each by itself lead to critical Kondo destruction. The zero-temperature residual entropy at various fixed points for the model is also discussed. The two channel Anderson model exhibits several continuous quantum phase transitions between weak- and strong-coupling phases. The non-crossing approximation (NCA) is believed to give reliable results for the standard two-channel Anderson model of a magnetic impurity in a metal. I revisit the reliability of the NCA for the standard two channel Anderson model (constant conduction electron density of states) and investigate its reliability for the two-channel pseudogap Anderson model. This is done by comparing finite-temperature, finite-frequency solutions of the NCA equations and asymptotically exact zero-temperature NCA solutions with numerical renormalization-group calculations. The phase diagram of this model is well established. The focus here will be on the dynamical scaling properties obtained within the NCA. Finally, I study the thermal and non-thermal steady state scaling functions and the steady-state dynamics of the pseudogap Kondo model. This model allows us to study the concept of effective temperatures near fully interacting as well as weak-coupling fixed points and compare the out-of-equilibrium scaling properties of critical Kondo destruction to those of the traditional spin-density wave (SDW) scenario. The differences I identify can be experimentally probed. This may be helpful in identifying the nature of the quantum critical points observed in certain heavy fermion compounds.

In der vorliegenden Arbeit wurde der elektrische Transport im Schwere-Fermionen-System YbRh2Si2 sowohl in seiner stöchiometrischen Form als auch mit teilweiser isoelektronischer Substitution von Ir oder Co auf dem Rh-Platz untersucht. In YbRh2Si2 liegt ein quantenkritischer Punkt vor, der zugänglich ist, indem der antiferromagnetische Phasenübergang mittels eines kleinen Magnetfelds zum absoluten Nullpunkt der Temperatur unterdrückt wird. Die zentralen Messungen des Hallkoeffizienten zeigen einen Übergang der in der Extrapolation zu T=0 zu einer Diskontinuität wird und somit auf eine Rekonstruktion der Fermifläche am quantenkritischen Punkt schließen lässt. Dies belegt die unkonventionelle Natur der Quantenkritikalität in YbRh2Si2. Unterstützt wird dies auf fundamentale Weise durch verknüpfungen mit unkonventionellem Skalierungsverhalten. In den Proben mit teilweiser Substitution wird der Einfluss einer Veränderung der Gitterparameter auf die Quantenkritikalität mit Hilfe von Widerstandsmessungen untersucht. Dabei zeigt sich, dass der magnetische Übergang von der Fermiflächenrekonstruktion separiert wird. Für Proben mit teilweiser Ir-Substitution, welche negativen Drücken entspricht, scheint im Zwischenbereich eine neuartige metallische Spinflüssigkeit hervorzutreten. / This work investigates the electrical transport of the heavy-fermion compound YbRh2Si2 in its stoichiometric form as well as with slight isoelectronic substitution of Ir or Co on the Rh site. A quantum critical point is present in YbRh2Si2 which is accessed by tuning the transition temperature of the antiferromagnetic order to absolute zero via the application of a small magnetic field. The central measurements of the Hall coefficient reveal a crossover which sharpens to a discontinuity in the extrapolation to zero temperature implying a reconstruction of the Fermi surface at the quantum critical point. This allows to rule out conventional descriptions of the quantum criticality in YbRh2Si2. A scaling analysis corroborates this on a fundamental basis. In the samples with partial substitution the effect of unit cell volume change on the quantum criticality was investigated by means of resistivity measurements. Surprisingly, the magnetic transition is separated from the Fermi surface reconstruction. For samples with Ir substitution corresponding to negative chemical pressure, a new metallic spin liquid seems to emerge in the intermediate regime.

Sr₃Ru₂O₇ is a quasi-two-dimensional metal and has a paramagnetic ground state that is heavily renormalised by electron-electron correlations and magnetic exchange interactions. Inextricably linked to this renormalisation is the metamagnetism of Sr₃Ru₂O₇ - a rapid rise in uniform magnetisation over a narrow range of applied magnetic field. Knowledge of the zero-field physics is essential to any description of the metamagnetism. Light may be shed on the enigmatic ground state of Sr₃Ru₂O₇ by doping the crystal lattice with foreign cations: this is the primary purpose of the original research referred to in this thesis, in which studies of some of the electronic properties of crystals of cation-doped Sr₃Ru₂O₇ are reported. Single crystals of Sr₃(Ru[subscript(1-x)]Ti[subscript(x)])₂O₇ and Sr₃(Ru[subscript(1-x)]Cr[subscript(x)])₂O₇ have been synthesised in an image furnace and some of the properties of these crystals have been measured. Evidence that indicates the emergence of a spin density wave as a function of Ti-doping in Sr₃(Ru[subscript(1-x)]Ti[subscript(x)])₂O₇ is presented. Time-dependent magnetic irreversibility has been observed in samples of Sr₃(Ru[subscript(1-x)]Cr[subscript(x)])₂O₇, thus hinting at the involvement of the RKKY mechanism in these materials. Regarding cation doping out of the conducting RuO₂ planes, samples of (Sr[subscript(1-y)]La[subscript(y)])₃Ru₂O₇ have been grown and investigated. Both the Sommerfeld coefficient and the Fermi liquid A coefficient of (Sr[subscript(1-y)]La[subscript(y)])₃Ru₂O₇ are found to decrease as a function of y (0 ≤ y ≤ 0.02); these observations point towards a reduction in the thermodynamic mass of the Landau quasiparticles. Results from magnetoresistance and magnetisation measurements indicate that the metamagnetism of the (Sr[subscript(1-y)]La[subscript(y)])₃Ru₂O₇ series probably cannot be explained by a rigid band-shift model. Also, some aspects of these data imply that the metamagnetism cannot be fully accounted for by a spin fluctuation extension to the Ginzburg-Landau theory of uniform magnetisation.