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The efficiency of silicon solar cells gradually decreases in various environments, with humidity being a key factor contributing to this decline through moisture-induced degradation (MID) involving multiple mechanisms including encapsulant…
Hydrogen bonds play a pivotal role in chemistry, biology, and condensed-matter physics, where quantum tunnelling can strongly influence structure and dynamics. Isotope substitution (H $\rightarrow$ D) provides a sensitive probe of such…
The quantum tunnelling and nucleation theory of vortices in helium II is reviewed. Arguments are given that the only reliable method to calculate tunnelling probabilities in this highly correlated, strongly interacting many-body system is…
Molecular hydrogen (H$_2$) plays a critical role in astrophysical processes from galaxy evolution to the formation of planets. While the dominant formation channel in the interstellar medium is considered as dust-catalyzed H$_2$ formation,…
This work is concerned with Al/Al-oxide(AlO$_{x}$)/Al-layer systems which are important for Josephson-junction-based superconducting devices such as quantum bits. The device performance is limited by noise, which has been to a large degree…
Surface oxides are associated with two-level systems (TLSs) that degrade the performance of niobium-based superconducting quantum computing devices. To address this, we introduce a predictive framework for selecting metal capping layers…
Defects such as vacancies and impurities could have profound effects on the transport properties of thermoelectric materials. However, it is usually quite difficult to directly calculate the thermoelectric properties of defect-containing…
In electrochemical systems, the structure of electrical double layers (EDLs) near electrode surfaces is crucial for energy conversion and storage functions. While the electrodes in real-world systems are usually heterogeneous, to date the…
The hydrogen-terminated Silicon(100)-2x1 surface (H-Si(100)-2x1) provides a promising platform for the development of atom scale devices, with recent work showing their creation through precise desorption of surface hydrogen atoms. While…
We present chemical abundance measurements from high resolution observations of 7 sub-damped Lyman-alpha absorbers and 1 damped Lyman-alpha system at z<1.5. Three of these objects have high metallicity, with near or super-solar Zn…
We present high resolution simulations of two-fluid (ion-neutral) MHD turbulence with resolutions as large as 512^3. The simulations are supersonic and mildly sub-Alfvenic, in keeping with the conditions present in molecular clouds. Such…
We propose defect lines as a useful tool to study bulk perturbations of conformal field theories, in particular to analyse the induced renormalisation group flows of boundary conditions. As a concrete example we investigate bulk…
Understanding the atomic-scale structure and dynamics of amorphous oxide surfaces is essential for interpreting their chemical reactivity, mechanical stability, and interfacial behavior, yet direct experimental characterization remains…
Nonequilibrium states of quantum materials can exhibit exotic properties and enable unprecedented functionality and applications. These transient states are inherently inhomogeneous, characterized by the formation of topologically protected…
Density functional theory (DFT) and DFT corrected for on-site Coulomb interactions (DFT+U) calculations are presented on Aluminium doping in bulk TiO$_2$ and the anatase (101) surface. Particular attention is paid to the mobility of oxygen…
We consider the fate of AdS vacua connected by tunneling events. A precise holographic dual of thin-walled Coleman--de Luccia bounces is proposed in terms of Fubini instantons in an unstable CFT. This proposal is backed by several…
Understanding native point defects is fundamental in order to comprehend the properties of TiO$_2$ anatase in technological applications. Several first-principles studies have been performed in order to investigate the defect chemistry of…
Damped Ly-alpha Systems (DLAs), with N(HI)>2*10^20 cm^{-2}, observed in quasars have allowed us to quantify the chemical content of the Universe over cosmological scales. Such studies can be extended to lower N(HI), in the sub-DLA range…
We investigate the feasibility of using high-harmonic generation (HHG) as a complementary probe of tunneling delay in strong-field ionization. By combining time--frequency analysis of HHG spectra obtained from full time-dependent…
Quantum turbulence is a far-from-equilibrium process characterized by high nonlinearity. Holographic duality provides a systematic framework for simulating the decaying $(3+1)$-dimensional quantum turbulence by numerically solving the dual…