A series of isostructural Ln3O2 (CN3)(Ln= La, Eu, Gd, Tb, Ho, Yb) oxoguanidinates was
synthesized under high‐pressure (25–54 GPa) high‐temperature (2000–3000 K) conditions …

In this study, we present the results of a search for new stable structures of SrC 2 O 5 and
BaC 2 O 5 in the pressure range of 0–100 GPa based on the density functional theory and …

The transition from structures with classical [CO3] triangles to structures with [CO4]
tetrahedra, corresponding to the transition from sp2 to sp3 hybridization of carbon atoms, is …

Based on the density functional theory and crystal structure prediction approaches, we found
a novel high-pressure structure of Fe 2 CO 4-P 1¯. It is characterized by the presence of …

Orthorhombic Ca2CO4 is a recently discovered orthocarbonate whose high-pressure
physical properties are critical for understanding the deep carbon cycle. Here, we study the …

A series of isostructural Ln3O2 (CN3)(Ln= La, Eu, Gd, Tb, Ho, Yb) oxoguanidinates was
synthesized under high-pressure (25–54 GPa) high-temperature (2000–3000 K) conditions …

In this work, the BeO–CO2 system was investigated in the pressure range from 0 to 50 GPa
based on first-principles calculations and modern crystal structure prediction approaches. As …

In this work, a detailed search for stable structures of the Na 2 C 2 O 5 composition was
carried out using first-principles calculations and modern crystal structure prediction …

За последние несколько лет понятие о карбонатах, как соединениях состава MeCO3 (
Meщелочноземельный металл), структуры которых характеризуются наличием [CO3] 2 …