Superconductivity in the Two-Orbital Hubbard Model of Infinite-Layer Nickelates

The pairing symmetry in infinite-layer nickelate superconductors has been an intriguing problem under heated debates. In this work, we study a two-orbital Hubbard model with one strongly correlated $3d$ orbital and one more itinerant $5d$ orbital, by using an eight-site cellular dynamic mean field theory study. We establish a superconducting phase diagram with $d_{x^{2}-y^{2}}$, $s_{\pm}$ and $d+is$ wave pairing symmetries, based on which we clarify the roles of various relevant parameters including hybridization $V$, itinerant carrier density $\langle n_{c}\rangle$ and interaction $U_{c}$. We show that the inclusion of a less correlated $5d$ band in general suppresses the $d_{x^{2}-y^{2}}$ wave pairing. We demonstrate that the $d+is$ wave is maximized when the $5d$ orbital has a large Coulomb repulsion with intermediate hybridization parameter. We perform fluctuation diagnostics to show that the driving force behind the $d_{x^{2}-y^{2}}$ wave is the intraband antiferromagnetic fluctuations in the $3d$ orbital, while for the $s_{\pm}$ wave, the pairing is mainly from the antiferromagnetic correlations residing on the local $3d$-$5d$ bond in real space.Comment: 8 pages, 5 figure

Charge Transfer and Zhang-Rice Singlet Bands in the Nickelate Superconductor La3Ni2O7\mathrm{La_3Ni_2O_7} under Pressure

Recently, a bulk nickelate superconductor $\mathrm{La_3Ni_2O_7}$ is discovered at pressures with a remarkable high transition temperature $T_c \sim 80K$. Here, we study a Hubbard model with tight-binding parameters derived from \textit{ab initio} calculations of $\mathrm{La_3Ni_2O_7}$, by employing large scale determinant quantum Monte Carlo and cellular dynamical mean-field theory. Our result suggests that the superexchange couplings in this system are comparable to that of cuprates. The system is a charge transfer insulator as hole concentration becomes four per site at large Hubbard $U$. Upon hole doping, two low-energy spin-singlet bands emerge in the system exhibiting distinct correlation properties: while the one composed of the out-of-plane Ni-$d_{3z^2-r^2}$ and O-$p_z$ orbitals demonstrates strong antiferromagnetic correlations and narrow effective bandwidth, the in-plane singlet band consisting of the Ni-$d_{x^2-y^2}$ and O-$p_x / p_y$ orbitals is in general more itinerant. Over a broad range of hole doping, the doped holes occupy primarily the $d_{x^2-y^2}$ and $p_x / p_y$ orbitals, whereas the $d_{3z^2-r^2}$ and $p_z$ orbitals retain underdoped. We propose an effective $t-J$ model to capture the relevant physics and discuss the implications of our result for comprehending the $\mathrm{La_3Ni_2O_7}$ superconductivity.Comment: Hund's coupling is discusse

Where to park an autonomous vehicle?:Results of a stated choice experiment

The future innovation and growing popularity of autonomous vehicles have the potential to significantly impact the spatiotemporal distribution of parking demand. However, little knowledge is gained on how people will choose to park their autonomous cars. In principle, an autonomous vehicle is not necessarily parked close by like traditional vehicles leveraging the automated driving and parking capability, still, the decision made by people is important for policymakers in urban and transportation planning. This study attempts to gain useful insights to understand people's parking location choices for autonomous vehicles. A stated choice experiment was designed, allowing people to choose a parking location for autonomous vehicles in varied contexts, including time windows, picking-up times, and the requirement for on-time arrival at the next activity. We found that similar to conventional cars people generally prefer cheaper and/or closer parking lots for autonomous vehicles. However, the distance between a parking lot and the activity location is relatively longer in the case of autonomous vehicles. The amount of time an autonomous vehicle spends in congestion while picking up the users influences the choice of parking locations. Moreover, substantial preference heterogeneity between individual people was found in the parking choice behavior. The maximum value of access time for autonomous cars is 34 $/h which is higher than the empirical value of walking time for conventional cars. Results of elasticity indicate that the influence of parking fees is larger than that of access time and congestion time.</p

High-TC_C superconductivity in La3Ni2O7\mathrm{La_3Ni_2O_7} based on the bilayer two-orbital t-J model

The recently discovered high-T$_C$ superconductor La$_3$Ni$_2$O$_7$ has sparked renewed interest in the unconventional superconductivity. Here we study the unconventional superconductivity in pressurized La$_3$Ni$_2$O$_7$ based on a bilayer two-orbital $t-J$ model, using the renormalized mean-field theory. Our results reveal a robust $s^\pm-$wave pairing driven by the inter-layer $d_{z^2}$ magnetic coupling, which exhibits a transition temperature within the same order of magnitude as the experimentally observed $T_c \sim 80$ K. We obtain a comprehensive superconducting phase diagram in the doping plane. Notably, the La$_3$Ni$_2$O$_7$ under pressure is found situated roughly in the optimal doping regime of the phase diagram. When the $d_{x^2-y^2}$ orbital becomes close to half-filling, $d-$wave and $d+is$ pairing can emerge from the system. We discuss the interplay between the Fermi surface topology and different pairing symmetries. The stability of the $s^\pm-$wave pairing against Hund's coupling and other magnetic exchange couplings is examined.Comment: 8 pages, 8 figure

Bilayer two-orbital model of La3_3Ni2_2O7_7 under pressure

The newly discovered Ruddlesden-Popper bilayer La$_3$Ni$_2$O$_7$ reaches an remarkable superconducting transition temperature $T_c$ = 80 K under a pressure of above 14 GPa. Here we propose a minimal bilayer two-orbital model of the high-pressure phase of La$_3$Ni$_2$O$_7$. Our model is constructed with the Ni-3d$_{x^2-y^2}$, 3d$_{3z^2-r^2}$ orbitals by using Wannier downfolding of the density functional theory calculations, which captures the key ingredients of the material, such as band structure and Fermi surface topology. There are two electron pockets $\alpha$, $\beta$ and one hole pocket $\gamma$ on the Fermi surface, in which the $\alpha$, $\beta$ pockets show mixing of two orbitals, while the $\gamma$ pocket is associated with Ni-d$_{3z^2-r^2}$ orbital. The RPA spin susceptibility reveals a magnetic enhancement associating to the d$_{3z^2-r^2}$ state. A higher energy model with O-p orbitals is also provided for further study

Possible Meissner effect near room temperature in copper-substituted lead apatite

With copper-substituted lead apatite below room temperature, we observe diamagnetic dc magnetization under magnetic field of 25 Oe with remarkable bifurcation between zero-field-cooling and field-cooling measurements, and under 200 Oe it changes to be paramagnetism. A glassy memory effect is found during cooling. Typical hysteresis loops for superconductors are detected below 250 K, along with an asymmetry between forward and backward sweep of magnetic field. Our experiment suggests at room temperature the Meissner effect is possibly present in this material.Comment: 7 pages, 4 figure

Observation of diamagnetic strange-metal phase in sulfur-copper codoped lead apatite

By codoping sulfur and copper into lead apatite, the crystal grains are directionally stacked and the room-temperature resistivity is reduced from insulating to $2\times10^{-5}~\Omega\cdot$m. The resistance-temperature curve exhibits a nearly linear relationship at low temperature suggesting the presence of strange-metal phase, and a second-order phase transition is then observed at around 230~K during cooling the samples. A possible Meissner effect is present in dc magnetic measurements. Further hydrothermal lead-free synthesis results in smaller resistance and stronger diamagnetism, demonstrating the essential component might be sulfur-substituted copper apatite and the alkalis matter as well. A clear pathway towards superconductivity in this material is subsequently benchmarked.Comment: 12 pages, 4 figure

Research on stress sensitivity of fractured carbonate reservoirs based on CT technology

Fracture aperture change under stress has long been considered as one of primary causes of stress sensitivity of fractured gas reservoirs. However, little is known about the evolution of the morphology of fracture apertures on flow property in loading and unloading cycles. This paper reports a stress sensitivity experiment on carbonate core plugs in which Computed Tomography (CT) technology is applied to visualize and quantitatively evaluate morphological changes to the fracture aperture with respect to confining pressure. Fracture models were obtained at selected confining pressures on which pore-scale flow simulations were performed to estimate the equivalent absolute permeability. The results showed that with the increase of confining pressure from 0 to 0.6 MPa, the fracture aperture and equivalent permeability decreased at a greater gradient than their counterparts after 0.6 MPa. This meant that the rock sample is more stress-sensitive at low effective stress than at high effective stress. On the loading path, an exponential fitting was found to fit well between the effective confining pressure and the calculated permeability. On the unloading path, the relationship is found partially reversible, which can evidently be attributed to plastic deformation of the fracture as observed in CT images

Flow simulation of artificially induced microfractures using digital rock and lattice boltzmann methods

Microfractures have great significance in the study of reservoir development because they are an effective reserving space and main contributor to permeability in a large amount of reservoirs. Usually, microfractures are divided into natural microfractures and induced microfractures. Artificially induced rough microfractures are our research objects, the existence of which will affect the fluid-flow system (expand the production radius of production wells), and act as a flow path for the leakage of fluids injected to the wells, and even facilitate depletion in tight reservoirs. Therefore, the characteristic of the flow in artificially induced fractures is of great significance. The Lattice Boltzmann Method (LBM) was used to calculate the equivalent permeability of artificially induced three-dimensional (3D) fractures. The 3D box fractal dimensions and porosity of artificially induced fractures in Berea sandstone were calculated based on the fractal theory and image-segmentation method, respectively. The geometrical parameters (surface roughness, minimum fracture aperture, and mean fracture aperture), were also calculated on the base of digital cores of fractures. According to the results, the permeability lies between 0.071&ndash;3.759 (dimensionless LB units) in artificially induced fractures. The wide range of permeability indicates that artificially induced fractures have complex structures and connectivity. It was also found that 3D fractal dimensions of artificially induced fractures in Berea sandstone are between 2.247 and 2.367, which shows that the artificially induced fractures have the characteristics of self-similarity. Finally, the following relations were studied: (a) exponentially increasing permeability with increasing 3D box fractal dimension, (b) linearly increasing permeability with increasing square of mean fracture aperture, (c) indistinct relationship between permeability and surface roughness, and (d) linearly increasing 3D box fractal dimension with increasing porosity