Related papers: Efficient full frequency GW for metals using a mul…
Compatibilized polymer blends are a complex, yet versatile and widespread category of material. When the components of a binary blend are immiscible, they are typically driven towards a macrophase-separated state, but with the introduction…
The effect of an oscillating electric field normal to a metallic surface may be described by an effective potential. This induced potential is calculated using semiclassical variants of the random phase approximation (RPA). Results are…
In this article we calculate the energy of an impurity weakly coupled to a spin 1/2 fermionic superfluid. We show that the divergences resulting from three-body physics can only be cured using a proper description of the excitations of the…
This paper considers the estimation and inference of the low-rank components in high-dimensional matrix-variate factor models, where each dimension of the matrix-variates ($p \times q$) is comparable to or greater than the number of…
A novel photonics-assisted method based on presampling and MDA technique is proposed for significantly improving the frequency estimation precision without introducing other complex algorithms. This method is also compatible with existing…
We present a low-complexity algorithm to calculate the correlation energy of periodic systems in second-order M\o ller-Plesset perturbation theory (MP2). In contrast to previous approximation-free MP2 codes, our implementation possesses a…
Polarimetric phased arrays (PPAs) enhance radar target detection and anti-jamming capabilities, but their conventional dual transmit/receive (T/R) channel architecture leads to high cost and system complexity. To address these limitations,…
The modified long-wavelength approximation (MLWA), a next order approximation beyond the Rayleigh limit, has been applied usually only to the dipole $\ell=1$ contribution and for the range of size parameters $x$ not exceeding $x\lesssim 1$…
We have implemented recently developed multiple-projector pseudopotentials into the planewave based auxiliary-field quantum Monte Carlo (pw-AFQMC) method. Multiple-projector pseudopotentials can yield smaller planewave cut-offs while…
The GW Approximation is an ab initio approach to calculating electronic structure which avoids using the Local Density (LDA) Approximation, the Generalized Gradient (GGA) Approximation, or similar density functionals. It goes beyond the…
For environmental, sustainable economic and political reasons, recycling processes are becoming increasingly important, aiming at a much higher use of secondary raw materials. Currently, for the copper and aluminium industries, no method…
We present a plane-wave (PW) implementation of the auxiliary-field quantum Monte Carlo (AFQMC) method within the projector augmented-wave (PAW) formalism in the Vienna ab initio Simulation Package (VASP). By employing an exact inversion of…
Recently, quantum corrections to optical conductivity of disordered metals up to the UV region were observed. Although this increase of conductivity with frequency, also called anti-Drude behaviour, should disappear at the electron…
In a previous work it was shown that the inclusion of exact exchange is essential for a first principles description of both the electronic- and the vibrational properties of TiSe$_2$, M. Hellgren et al. [Phys. Rev. Lett. 119, 176401…
We present a many-body $GW$ formalism for quantum subsystems embedded in discrete polarizable environments containing up to several hundred thousand atoms described at a fully ab initio random phase approximation level. Our approach is…
We derive analytical expressions for chemical potentials within the random phase approximation (RPA), equivalently the $GW$ energy functional evaluated using non interacting Green's functions ($G_s$). The chemical potential is obtained…
By measuring angular-oscillation behavior of the heat capacity with respect to the applied field direction, one can detect the details of the gap structure. We introduce the Kramer-Pesch approximation (KPA) as a new method to analyze the…
Due to their quantitative nature, probabilistic programs pose non-trivial challenges for designing compositional and efficient program analyses. Many analyses for probabilistic programs rely on iterative approximation. This article presents…
A novel method based on pulse area analysis(PAA) was presented for acquisition nuclear spectrum by the digitizer. PAA method can be used as a substitute for the traditional method of pulse height analysis (PHA). In the PAA method a…
Multi-channel analysers (MCAs) play a crucial role in spectral measurements, especially in the context of Silicon Photomultipliers (SiPMs) used for gamma spectroscopy. Most commercial MCAs, while highly accurate, remain cost-prohibitive for…