Crystal engineering of pharmaceutical cocrystals in the discovery and development of improved drugs

G Bolla, B Sarma, AK Nangia - Chemical reviews, 2022 - ACS Publications
The subject of crystal engineering started in the 1970s with the study of topochemical
reactions in the solid state. A broad chemical definition of crystal engineering was published …

The concept of active site in heterogeneous catalysis

C Vogt, BM Weckhuysen - Nature Reviews Chemistry, 2022 - nature.com
Catalysis is at the core of chemistry and has been essential to make all the goods
surrounding us, including fuels, coatings, plastics and other functional materials. In the near …

[HTML][HTML] A step-by-step guide to perform x-ray photoelectron spectroscopy

G Greczynski, L Hultman - Journal of Applied Physics, 2022 - pubs.aip.org
There is a growing concern within the surface science community that the massive increase
in the number of XPS articles over the last few decades is accompanied by a decrease in …

Organic–inorganic perovskites: structural versatility for functional materials design

B Saparov, DB Mitzi - Chemical reviews, 2016 - ACS Publications
Although known since the late 19th century, organic–inorganic perovskites have recently
received extraordinary research community attention because of their unique physical …

[BOOK][B] Polymer interface and adhesion

S Wu - 2017 - taylorfrancis.com
Poly mer Interface and Adhesion provides the critical basis for further advancement in
thisfield. Combining the principles of interfacial science, rheology, stress analysis, and …

Radiochemistry for positron emission tomography

J Rong, A Haider, TE Jeppesen, L Josephson… - Nature …, 2023 - nature.com
Positron emission tomography (PET) constitutes a functional imaging technique that is
harnessed to probe biological processes in vivo. PET imaging has been used to diagnose …

Cellulose and the role of hydrogen bonds: not in charge of everything

M Wohlert, T Benselfelt, L Wågberg, I Furó… - Cellulose, 2022 - Springer
In the cellulose scientific community, hydrogen bonding is often used as the explanation for
a large variety of phenomena and properties related to cellulose and cellulose based …

A generally applicable atomic-charge dependent London dispersion correction

E Caldeweyher, S Ehlert, A Hansen… - The Journal of …, 2019 - pubs.aip.org
The so-called D4 model is presented for the accurate computation of London dispersion
interactions in density functional theory approximations (DFT-D4) and generally for atomistic …

Rational design of layered oxide materials for sodium-ion batteries

C Zhao, Q Wang, Z Yao, J Wang, B Sánchez-Lengeling… - Science, 2020 - science.org
Sodium-ion batteries have captured widespread attention for grid-scale energy storage
owing to the natural abundance of sodium. The performance of such batteries is limited by …

Molecular electrostatic potential analysis: A powerful tool to interpret and predict chemical reactivity

CH Suresh, GS Remya… - Wiley Interdisciplinary …, 2022 - Wiley Online Library
The molecular electrostatic potential (MESP) V (r) data derived from a reliable quantum
chemical method has been widely used for the interpretation and prediction of various …