The Wien2k code is widely used for the calculation of electron energy loss spectra. Low loss
spectra can be calculated with the OPTIC package while core loss spectra are calculated …

The microstructure and electronic structure of environmentally relevant carbons such as
Euro IV heavy duty diesel engine soot, soot from a black smoking diesel engine, spark …

A series of carbon nitride structures have been generated, by using a classical potential in a
Metropolis Monte Carlo liquid quench procedure. The resulting structures are relaxed further …

Hydrogenated amorphous carbon thin films (a: CH) are very promising materials for
numerous applications. The growing of relevance of a: CH is mainly due to the long-term …

Topological defects are widely recognized as effective active sites toward a variety of
electrochemical reactions. However, the role of defect curvature is still not fully understood …

The quantitative determination of the carbon hybridization is critical for establishing
processing-structure-properties relationships for carbon-based materials, including …

Developing high‐performance carbonaceous anode materials for sodium‐ion batteries
(SIBs) is still a grand quest for a more sustainable future of energy storage. Introducing sulfur …

Glassy carbon is a technologically important material with isotropic properties that is
nongraphitizing up to∼ 3000° C and displays complete or “superelastic” recovery from large …

We present an efficient method for the quantification of crystalline versus amorphous phase
content in mesoporous materials, making use of electron energy loss spectroscopy. The …

We have performed X-ray photoelectron spectroscopy (XPS) and high energy electron
energy-loss spectroscopy (HEELS) calculations from first principles on a series of Monte …