Zeolites are versatile and fascinating materials which are vital for a wide range of industries,
due to their unique structural and chemical properties, which are the basis of applications in …

Zeolites are an important class of inorganic crystalline materials that have been widely used
in the fields of petroleum refining, petrochemical industry, and fine chemical industry, as …

Microwave heating, used in organic chemistry for several decades, has only recently been
applied to the preparation of multi-dimensional coordination polymers, more commonly …

The prediction of structure at the atomic level is one of the most fundamental challenges in
condensed matter science. Here we survey the current status of the field and consider recent …

The conditions required to produce zeolites with low framework density and extra‐large
pores are discussed. Correlations between framework stability and geometrical and …

Zeolites are porous aluminosilicate materials that have found applications in many different
technologies. However, although simulations suggest that there are millions of possible …

We here describe a database of computationally predicted zeolite-like materials. These
crystals were discovered by a Monte Carlo search for zeolite-like materials. Positions of Si …

Over the past twenty five years, a class of open-framework aluminophosphates, denoted
AlPOs, has been prepared with neutral zeolitic frameworks and anionic frameworks showing …

We use periodic DFT calculations to compute the total energy of known zeolitic imidazole
frameworks (ZIFs) together with those of hypothetical porous ZIFs. We show that the total …

The targeted design and simulation of a new family of zeolitic metal− organic frameworks
(MOFs) based on benzenedicarboxylate (BDC) as the ligand and ε-type Keggin …