Recently, static pressures of more than 1.0 TPa have been reported, which raises the
question: what is the maximum static pressure that can be achieved using diamond anvil cell …

Due to the influence factors such as pulp ions and surface conversion, efficient flotation
separation of smithsonite from calcite remains a challenge in the actual system. In this …

Within the framework of the density functional theory (DFT) and the hybrid functional B3LYP
by means of the CRYSTAL17 program code, the wavenumbers and intensities of normal …

This work explores the potential of carbonate-based ceramics (CBC) as materials for optical
and radiation shielding applications. The results reveal the distinctive behavior of various …

Using the density functional theory with the hybrid functional B3LYP and the basis of
localized orbitals of the CRYSTAL17 program code, the dependences of the wavenumbers …

Carbonate materials have been increasingly favoured in terms of the development of flame
retardants because of the eternal subject of inorganic carbon sequestration. In this regard …

Zinc K-edge X-ray absorption near-edge (XANES) spectroscopy was conducted on 40 zinc
mineral samples and organic compounds. The K-edge position varied from 9660.5 to 9666.0 …

Using the ab initio methods of the density functional theory, the influence of hydrostatic
pressure on the elastic properties of magnesium, zinc, cadmium, calcium carbonates with …

Using the density functional theory methods with the PBE gradient functional, and taking into
account the van der Waals interaction in the basis of localized atomic orbitals, using the …

The phase transitions of natural San Carlos Fe‐, Al‐and Ca‐bearing orthopyroxene and two
synthetic orthopyroxenes containing Al (up to 12 wt.% Al2O3) and Fe (up to 15 wt.% FeO) …