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Configuration-interaction-type calculations on electronic and vibrational structure are often the method of choice for the reliable approximation of many-particle wave functions and energies. The exponential scaling, however, limits their…
The high-temperature ratio (HTR) is a parameter quantifying changes of the shape of the high-temperature part of the LiF:Mg,Ti glow-curve after exposure to densely ionizing radiation. It was introduced in order to estimate the effective LET…
We present improved empirical density profiles of Uranus and interpret them in terms of their temperature and composition using a new random algorithm. The algorithm to determine the temperature and composition is agnostic with respect to…
The usefulness of semi-analytical thermal models for predicting the connection between process, microstructure and properties in powder bed fusion has been well illustrated in recent years. Such an approach provides the promise of accuracy…
We present a computational method to accurately calculate Raman spectra from first principles with an at least one order of magnitude higher efficiency. This scheme thus allows to routinely calculate finite-temperature Raman spectra…
HCN is becoming a popular choice of molecule for studying star formation in both low- and high-mass regions and for other astrophysical sources from comets to high-redshift galaxies. However, a major and often overlooked difficulty with HCN…
We implement and apply time-dependent density matrix renormalization group (TD-DMRG) algorithms at zero and finite temperature to compute the linear absorption and fluorescence spectra of molecular aggregates. Our implementation is within a…
CO observations in active galactic nuclei and star-bursts reveal high kinetic temperatures. Those environments are thought to be very turbulent due to dynamic phenomena such as outflows and high supernova rates. We investigate the effect of…
The [$^{12}$C II] emission at 158 $\mu$m is a key cooling line of the interstellar medium and traces gas kinematics in spectrally resolved observations. Its spectral profile is often modified by optical depth effects. The intrinsic line…
The problem of $H_{\infty}$ filtering for attitude estimation using rotation matrices and vector measurements is studied. Starting from a storage function on the Special Orthogonal Group $SO(3)$, a dissipation inequality is considered, and…
In this paper we employ the Renormalization Group (RG) method to study higher order corrections to the long-time asymptotics of a class of nonlinear integral equations with a generalized heat kernel and with time-dependent coefficients.…
The experimental investigation of matter under extreme densities and temperatures as they occur for example in astrophysical objects and nuclear fusion applications constitutes one of the most active frontiers at the interface of material…
The low temperature thermodynamics of correlated 1D fermionic models with spin and charge degrees of freedom is obtained by exact diagonalization (ED) of small systems and followed by density matrix renormalization group (DMRG) calculations…
We present a Faraday rotation spectroscopy (FRS) technique for measurements on the micron scale. Spectral acquisition speeds of many orders of magnitude faster than state-of-the-art modulation spectroscopy setups are demonstrated. The…
A general method for the direct evaluation of the temperature dependence of the quantum-mechanical reaction rate constant in many-dimensional systems is described. The method is based on the quantum instanton approximation for the rate…
Dense plasmas occur in stars, giant planets and in inertial fusion experiments. Accurate modeling of the electronic structure of these plasmas allows for prediction of material properties that can in turn be used to simulate these…
The Molten Salt Fast Reactor (MSFR) has the particularity that the coolant is also the fuel, which tightens the coupling between neutronics and thermal hydraulics as the fuel circulates through the primary system. Therefore, developing…
From the analysis of light (anti)nuclei multiplicities that were measured recently by the ALICE collaboration in Pb+Pb collisions at the center-of-mass collision energy $\sqrt{s_{NN}} =2.76$ TeV there arose a highly non-trivial question…
The spin-lattice relaxation rate $1/T_1$ and the spin echo decay rate $1/T_{2G}$ for the spin-$1\over 2$ antiferromagnetic Heisenberg chain are calculated using quantum Monte Carlo and maximum entropy analytic continuation. The results are…
Accurate numerical simulations of a doped t-J model on a two-leg ladder are presented for the particle number, chemical potential, magnetic susceptibility and entropy in the limit of large exchange coupling on the rung using a finite…