Maksim V. Banaev

Часть публикаций из профиля, по году от новых к старым. Это не полный список последних работ автора; работы без года — в конце.

• New High‐Pressure Polymorphs of Rb 2 CO 3 and Cs 2 CO 3 : Crystal Structure Prediction and P–T Phase Diagrams2026
• First observation of dynamic disorder of pyroborate group via molecular dynamics simulation of Sr 2 B 2 O 52026
• Revised phase relations of Li2C2O5 compound at high pressures: DFT study2026
• K2C2O5─The First Finding of Pyrocarbonate Stable at Ambient Pressure2025
• P−T phase diagram of Na 2 C 2 O 5 at pressures up to 100 GPa2024
• Crystal structures and P–T phase diagrams of SrC2O5 and BaC2O52023
• High-pressure transformations of CaC 2 O 5 – a full structural trend from double [CO 3 ] triangles through the isolated group of [CO 4 ] tetrahedra to framework and layered structures2022 · аннотациясвернуть

  Using ab initio crystal structure prediction technique, we reveal novel structure of CaC 2 O 5 , Ca-pyrocarbonate with symmetry Cc , which stabilizes at 10 GPa. This structure is characterized by the isolated [C 2 O 5 ]…

• High‐Pressure Crystal Structures of Pb 2 CO 4 and PbC 2 O 5 with Tetrahedral [CO 4 ] and Pyrocarbonate [C 2 O 5 ] atomic groups2022