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We use angle-resolved photoemission spectroscopy (ARPES) and density functional theory (DFT) calculations to study the electronic structure of CaFe$_2$As$_2$ in previously unexplored collapsed tetragonal (CT) phase. This unusual phase of…
Many remarkable properties of quantum materials emerge from states with intricate coupling between the charge, spin and orbital degrees of freedom. Ultrafast photo-excitations of these materials hold great promise for understanding and…
Nitrogen is one of the most abundant metals in the interstellar medium (ISM), and thus it constitutes an excellent test to study a variety of astrophysical environments, ranging from nova to active galactic nuclei. We present a detailed…
We investigate the evolution of extreme ultraviolet (XUV) spectral lineshapes in an optically-thick helium gas under near-infrared (IR) perturbation. In our experimental and theoretical work, we systematically vary the IR intensity,…
We devise a theoretical description for the response of nitrogen molecules (N2) to ultrashort and intense x rays from the free electron laser (FEL) Linac Coherent Light Source (LCLS). We set out from a rate-equation description for the…
Impulsive X-ray Raman excitations of Lithium, Neon, and Sodium are calculated using the Multiconfiguration Time-Dependent Hartree-Fock method. Using linearly polarized laser pulses without chirp, we determine the optimum central frequency,…
Core level binding energies and absorption edges are at the heart of many experimental techniques concerned with element-specific structure, electronic structure, chemical reactivity, elementary excitations and magnetism. X-ray…
For a detailed understanding of chemical processes in nature and industry, we need accurate models of chemical reactions in complex environments. While Eyring transition state theory is commonly used for modeling chemical reactions, it is…
In this paper we report on the broadband X-ray properties of a complete sample of 33 absorbed Seyfert galaxies hard X-ray selected with integral. The high quality broadband spectra obtained with both xmm, and integral-IBIS data are well…
We investigate both the systematic and statistical uncertainties associated with theoretical nuclear reaction rates of relevance during the i-process and explore their impact on the i-process elemental production, and subsequently on the…
Time-resolved X-ray absorption spectroscopy (TR-XAS), based on laser-pump/X-ray probe method, is powerful in capturing the change of geometrical and electronic structure of the absorbing atom upon excitation. TR-XAS data analysis is…
Active galactic nuclei (AGN) drive powerful, multiphase outflows that are thought to play a key role in galaxy evolution. The hot, shocked phase of these outflows ($T \gtrsim 10^{6} \rm{\ K}$) is expected to dominate the energy content, but…
Transition metal surfaces catalyse a broad range of thermally-activated reactions involving carbon-containing-species -- from atomic carbon to small hydrocarbons or organic molecules, and polymers. These reactions yield well-separated…
Infrared reflection absorption spectroscopy (IRAS) offers a powerful route to bridging the materials and pressure gaps between surface science and powder catalysis. Using a newly developed IRAS setup optimised for dielectric single…
We present a hyperfine-resolved state preparation scheme for thallium fluoride (TlF) molecules based on microwave-driven adiabatic passage (AP) in a spatially varying electric field. This method enables efficient and robust population…
Recent observations with the dispersive X-ray spectrometers aboard Chandra and Newton Observatory have begun to probe the properties of the X-ray intergalactic medium (IGM) at small redshifts. Using large quantities (~950 ksec) of…
In this paper we explore collisional ionization and time-evolving photoionization in the, X-ray discovered, ionized absorbers in Seyfert galaxies. These absorbers show temporal changes inconsistent with simple equilibrium models. We develop…
We have used post-synthesis separation methods based on density gradient ultracentrifugation and DNA-based ion-exchange chromatography to produce aqueous suspensions strongly enriched in armchair nanotubes for spectroscopic studies. Through…
Structurally well-defined TIPS-acetylene substituted tetracene (TIPS BT1') and pentacene (TIPS BP1') dimers utilizing a [2.2.1] bicyclic norbornyl bridge have been studied -primarily using time-resolved spectroscopic methods - to uncover…
Time-resolved transient absorption spectroscopy has been used to study nanosecond and sub-microsecond electron dynamics in aqueous anatase nanoparticles in the presence of hole scavengers: chemisorbed polyols and carbohydrates. These…