Chemically tuned intermediate band states in atomically thin CuGeSe/SnS quantum material for photovoltaic applications.

A new generation of quantum material derived from intercalating zerovalent atoms such as Cu into the intrinsic van der Waals gap at the interface of atomically thin two-dimensional GeSe/SnS heterostructure is designed, and their optoelectronic features are explored for next-generation photovoltaic applications. Advanced ab initio modeling reveals that many-body effects induce intermediate band (IB) states, with subband gaps (~0.78 and 1.

Tailoring Ultrafast Near-Band Gap Photoconductive Response in GeS by Zero-Valent Cu Intercalation.

Zero-valent intercalation of atomic metals into the van der Waals gap of layered materials can be used to tune their electronic, optical, thermal, and mechanical properties. Here, we report the impact of intercalating ∼3 atm percent of zero-valent copper into germanium sulfide (GeS). Advanced many-body calculations predict that copper introduces quasi-localized intermediate band states, and time-resolved THz spectroscopy studies demonstrate that those states have prominent effects on the photoconductivity of GeS.

Discrimination of 1- and 2-Propanol by Using the Transient Current Change of a Semiconducting ZnFe O Chemiresistor.

A semiconducting metal oxide (SMO) chemiresistor (ZnFe O ) is used for discriminating two isomeric volatile organic compounds (VOCs), namely 1- and 2-propanol. The transient current of the SMO chemiresistor is correlated with the aerobic oxidation of organic vapors on its surface. The changes in transient current of the ZnFe O chemiresistor are measured at different temperatures (260-320 °C) for detecting equal concentrations (200 ppm) of the two structural isomers of propanol.

Effective cluster typical medium theory for the diagonal Anderson disorder model in one- and two-dimensions.

We develop a cluster typical medium theory to study localization in disordered electronic systems. Our formalism is able to incorporate non-local correlations beyond the local typical medium theory in a systematic way. The cluster typical medium theory utilizes the momentum-resolved typical density of states and hybridization function to characterize the localization transition.

First-principles Wannier function analysis of the electronic structure of PdTe: weaker magnetism and superconductivity.

We report a first-principles Wannier function study of the electronic structure of PdTe. Its electronic structure is found to be a broad three-dimensional Fermi surface with highly reduced correlation effects. In addition, the higher filling of the Pd d-shell, its stronger covalency resulting from the closer energy of the Pd d and Te p shells, and the larger crystal field effects of the Pd ion due to its near octahedral coordination, all serve to weaken significantly electronic correlations in the particle-hole (spin, charge, and orbital) channel.