The recent rise of computational, data-driven research has significant potential to accelerate
materials discovery. Automated workflows and materials databases are being rapidly …

We review the field of organic–inorganic nanocomposites with a focus on materials that
exhibit a significant degree of electronic coupling across the hybrid interface. These …

Indium phosphide quantum dots are the main alternative for toxic and restricted Cd-based
quantum dots for lighting and display applications, but in the absence of protecting ZnSe …

Semiconductor nanocrystals exhibit attractive photophysical properties for use in a variety of
applications. Advancing the efficiency of nanocrystal-based devices requires a deep …

The adaptation of colloidal semiconductor nanocrystals (NCs) in applications like displays,
photovoltaics, and photocatalysis relies primarily on the core electronic structure of NC …

Quantum dots (QDs) are known for their size-dependent optical properties, narrow emission
bands, and high photoluminescence quantum yield (PLQY), which make them interesting …

Lead halide perovskite nanocrystals have drawn attention as active light-absorbing or-
emitting materials for opto-electronic applications due to their facile synthesis, intrinsic defect …

Although density functional theory (DFT) calculations have been crucial in our
understanding of colloidal quantum dots (QDs), simulations are commonly carried out on QD …

Colloidal nanoplatelets (NPLs) are promising materials for lasing applications. The
properties are usually discussed in the framework of 2D materials, where strong excitonic …

Dynamic nuclear polarization (DNP) solid-state NMR (SSNMR) spectroscopy was used to
obtain detailed surface structures of zinc blende CdSe nanocrystals (NCs) with plate or …