Search results for "Photoabsorption"
showing 7 items of 7 documents
First-principles nonequilibrium Green's-function approach to transient photoabsorption: Application to atoms
2015
We put forward a first-principle NonEquilibrium Green's Function (NEGF) approach to calculate the transient photoabsorption spectrum of optically thin samples. The method can deal with pump fields of arbitrary strength, frequency and duration as well as for overlapping and nonoverlapping pump and probe pulses. The electron-electron repulsion is accounted for by the correlation self-energy, and the resulting numerical scheme deals with matrices that scale quadratically with the system size. Two recent experiments, the first on helium and the second on krypton, are addressed. For the first experiment we explain the bending of the Autler-Townes absorption peaks with increasing the pump-probe d…
A photoswitchable helical peptide with light-controllable interface/transmembrane topology in lipidic membranes
2021
Summary The spontaneous insertion of helical transmembrane (TM) polypeptides into lipid bilayers is driven by three sequential equilibria: solution-to-membrane interface (MI) partition, unstructured-to-helical folding, and MI-to-TM helix insertion. A bottleneck for understanding these three steps is the lack of experimental approaches to perturb membrane-bound hydrophobic polypeptides out of equilibrium rapidly and reversibly. Here, we report on a 24-residues-long hydrophobic α-helical polypeptide, covalently coupled to an azobenzene photoswitch (KCALP-azo), which displays a light-controllable TM/MI equilibrium in hydrated lipid bilayers. FTIR spectroscopy reveals that trans KCALP-azo folds…
Time-dependent density-functional theory in the projector augmented-wave method
2008
We present the implementation of the time-dependent density-functional theory both in linear-response and in time-propagation formalisms using the projector augmented-wave method in real-space grids. The two technically very different methods are compared in the linear-response regime where we found perfect agreement in the calculated photoabsorption spectra. We discuss the strengths and weaknesses of the two methods as well as their convergence properties. We demonstrate different applications of the methods by calculating excitation energies and excited state Born–Oppenheimer potential surfaces for a set of atoms and molecules with the linear-response method and by calculating nonlinear e…
Silicon-microring into a fiber laser cavity for high-repetition-rate pulse train generation
2017
International audience; In 1997, Yoshida et al. inserted a Fabry-Perot filter in a modulation instability fiber laser cavity [1], the free spectral range (FSR) of the Fabry-Perot fixed the RF to 115 GHz; however the pulsed laser was poorly stable. Since then, lasers of increasing performance have been demonstrated using variants of this method. In 2012, Peccianti et al., demonstrated the first fiber laser harmonically mode-locked by integrated high-finesse microresonator [2]. The doped silica, on-chip microresonator provided both high spectral selectivity and nonlinearity, thus promoting the dynamics pulsed at 200 GHz. By using a silicon microring resonator (SMRR), this approach lead to the…
Helicity dependence of the total inclusive cross section on the deuteron
2009
Abstract A measurement of the helicity dependence of the total inclusive photoabsorption cross section on the deuteron was carried out at MAMI (Mainz) in the energy range 200 E γ 800 MeV . The experiment used a 4 π detection system, a circularly polarized tagged photon beam and a frozen spin target which provided longitudinally polarized deuterons. These new results are a significant improvement on the existing data and allow a detailed comparison with state-of-the-art calculations.
Time-resolved photoabsorption in finite systems: A first-principles NEGF approach
2016
We describe a first-principles NonEquilibrium Green’s Function (NEGF) approach to time-resolved photoabsortion spectroscopy in atomic and nanoscale systems. The method is used to highlight a recently discovered dynamical correlation effect in the spectrum of a Krypton gas subject to a strong ionizing pump pulse. We propose a minimal model that captures the effect, and study the performance of time-local approximations versus time-nonlocal ones. In particular we implement the time-local Hartree-Fock and Markovian second Born (2B) approximation as well as the exact adiabatic approximation within the Time-Dependent Density Functional Theory framework. For the time-nonlocal approximation we ins…
Excited States Calculations of MoS2@ZnO and WS2@ZnO Two-Dimensional Nanocomposites for Water-Splitting Applications
2021
This research was funded by the Latvian Scientific Council grant LZP-2018/2-0083. Institute of Solid State Physics, University of Latvia, as the Center of Excellence, has received funding from the European Union's Horizon 2020 Framework Program H2020-WIDESPREAD-01-2016-2017-TeamingPhase2 under Grant Agreement No. 739508, project CAMART2.