interest

High-performance methods in chemistry

Nelyubina Yulia
🤝
DSc in Chemistry
A.N.Nesmeyanov Institute of Organoelement Compounds of the Russian Academy of Sciences
A.N.Nesmeyanov Institute of Organoelement Compounds of the Russian Academy of Sciences
Moscow Institute of Physics and Technology
Moscow Institute of Physics and Technology
Bauman Moscow State Technical University
Bauman Moscow State Technical University
494 publications,  6 673 citations
h-index: 35
Research interests
3D printing
Coordination Chemistry
Crystal Engineering
Crystalline materials
Crystallography
Electron density distribution
High-performance methods in chemistry
Hybrid perovskites
In situ crystallography
Magnetic materials
Metal-organic coordination polymers
Molecular design
Molecular magnetism
Non-valent interactions
Paramagnetic NMR spectroscopy
Polymorphism
Sensorics
Spintronics
Supramolecular chemistry
Redkov Aleksey
PhD in Physics and Mathematics
Institute of Problems of Mechanical Engineering of the Russian Academy of Sciences
Institute of Problems of Mechanical Engineering of the Russian Academy of Sciences
87 publications,  567 citations
h-index: 14
Research interests
Computational Physics
Computer simulation
Crystal Chemistry
Crystal Engineering
Crystalline materials
Crystallography
Glass
High-performance methods in chemistry
Machine learning
Molecular beam epitaxy
Nanotechnology
Physics of semiconductors
Semiconductor nanocrystals
Sensorics
Oleynichenko Alexander
PhD in Physics and Mathematics
Moscow Institute of Physics and Technology
Moscow Institute of Physics and Technology
Petersburg Nuclear Physics Institute of NRC «Kurchatov Institute»
Petersburg Nuclear Physics Institute of NRC «Kurchatov Institute»
32 publications,  276 citations
h-index: 10
Research interests
Density functional theory (DFT)
High-performance methods in chemistry
Multi-configuration methods
Multireference coupled cluster method
Quantum Chemistry
Relativistic quantum chemistry
The Coupled cluster theory method
The method of relativistic pseudopotential