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Computational chemistry
Novikov Alexander
🥼
🤝
🔍
PhD in Chemistry
Saint Petersburg State University
ITMO University
Lomonosov Moscow State University
Peoples' Friendship University of Russia
380
publications,
6 646
citations
h
-index:
48
Research interests
Computational chemistry
Machine learning
Non-covalent Interactions
Quantum Chemistry
Reaction mechanisms
Supramolecular chemistry
Sorokin Pavel
🥼
🤝
DSc in Physics and Mathematics, Associate Professor
National University of Science & Technology (MISiS)
195
publications,
7 309
citations
h
-index:
39
Research interests
2D Materials
Ab initio
Computational chemistry
Condensed matter physics
Density functional theory (DFT)
Machine learning
Magnetic materials
Materials science
Metals and alloys
Nanomaterials
Nanomaterials for biomedicine
Non-covalent Interactions
Quantum Chemistry
Solid State Physics
Thin films
Thin solid films
Tchougreeff Andrei
🥼
DSc in Physics and Mathematics
A.N. Frumkin Institute of Physical Chemistry and Electrochemistry of the Russian Academy of Sciences
122
publications,
6 423
citations
h
-index:
17
Research interests
1D Materials
2D Materials
Chemical physics
Computational chemistry
Condensed matter physics
Coordination Chemistry
Physical Chemistry
Quantum Chemistry
Theoretical Chemistry
Komarov Pavel
DSc in Physics and Mathematics, Associate Professor
A.N.Nesmeyanov Institute of Organoelement Compounds of the Russian Academy of Sciences
Tver State University
107
publications,
1 170
citations
h
-index:
17
Research interests
Computational chemistry
Computer simulation
Molecular modeling
Nanotechnology
Physical Chemistry
R&D
Soft environments
Soft matter
Ksenofontov Alexander
🥼
🤝
PhD in Chemistry
G.A. Krestov Institute of Solution Chemistry of the Russian Academy of Sciences
85
publications,
811
citations
h
-index:
15
Research interests
Computational chemistry
Coordination Chemistry
Data Science
Fluorescence
Machine learning
Photochemistry
Physical Chemistry
Tyurin Daniil
PhD in Chemistry
Lomonosov Moscow State University
68
publications,
631
citations
h
-index:
15
Research interests
Ab initio
Astrophysics
Chemical Physics
Computational chemistry
Computational methods in chemistry
Cryogenic technology
EPR spectroscopy
High-performance computing
IR spectroscopy
Interaction of X-ray and synchrotron radiation with matter
Matrix isolation
Matrix isolation
Molecular modeling
Molecular spectroscopy
Non-covalent Interactions
Non-valent interactions
Photochemistry
Physical Chemistry
Quantum Chemistry
Reaction mechanisms
Singlet oxygen
Space research
Spectroscopy
X-ray radiation
Gurina Darya
PhD in Chemistry
G.A. Krestov Institute of Solution Chemistry of the Russian Academy of Sciences
59
publications,
362
citations
h
-index:
11
Research interests
Chemical physics
Computational chemistry
Voronin Alexander
🤝
PhD in Chemistry
G.A. Krestov Institute of Solution Chemistry of the Russian Academy of Sciences
53
publications,
1 060
citations
h
-index:
21
Research interests
Computational chemistry
Crystal Chemistry
Development of drug candidates and leaders
Non-valent interactions
Physical Chemistry
Supramolecular chemistry
Thermodynamics
Piyanzina Irina
🥼
🤝
PhD in Physics and Mathematics
Kazan Scientific Center of the Russian Academy of Sciences
Kazan Federal University
49
publications,
243
citations
h
-index:
8
Research interests
Computational chemistry
Computer simulation
Condensed matter physics
Density functional theory (DFT)
Machine learning
Magnetic materials
Materials science
Molecular dynamics
Multiferroics
Polymer science
Thin films
Eliseev Artem
PhD in Chemistry
Kurnakov Institute of General and Inorganic Chemistry of the Russian Academy of Sciences
Lomonosov Moscow State University
43
publications,
443
citations
h
-index:
13
Research interests
Computational chemistry
Machine learning
Magnetic materials
Materials science
Membrane materials
Samuilov Aleksandr
PhD in Chemistry
Kazan National Research Technological University
39
publications,
218
citations
h
-index:
9
Research interests
Ab initio
Computational chemistry
Density functional theory (DFT)
Green chemistry
Green technologies
Hydrogen-bonded organic polymers
Otlyotov Arseniy
🥼
🤝
PhD in Chemistry
N.N. Semenov Federal Research Center for Chemical Physics of the Russian Academy of Sciences
33
publications,
181
citations
h
-index:
8
Research interests
Ab initio
Computational chemistry
Conformational analysis
Density functional theory (DFT)
Gas electronography
Solvation
Thermodynamics
Kozhevnikova Ekaterina
Moscow Institute of Physics and Technology
Joint Institute for High Temperatures of the Russian Academy of Sciences
16
publications,
263
citations
h
-index:
5
Research interests
2D Materials
Carbon materials
Chemistry of natural compounds
Computational chemistry
Density functional theory (DFT)
Electrochemistry
Gas sensors
Physical and chemical materials science
Pytnon
Solid State Physics
Ganiev Baktiyor
🤝
Bukhara State University
12
publications,
26
citations
h
-index:
3
Research interests
Computational chemistry
Coordination Chemistry
Crystal Chemistry
Quantum Chemistry
Quantum computing
Synthetic Organic Chemistry
Kaplanskiy Mark
Saint Petersburg State University
7
publications,
8
citations
h
-index:
2
Research interests
Ab initio MD
Computational chemistry
Quantum Chemistry
Supramolecular chemistry
Noev Alexey
🤝
MIREA — Russian Technological University
7
publications,
54
citations
h
-index:
4
Research interests
Computational chemistry
Drug design
Medicinal Chemistry
Photopharmacology
Smirnova Anastasiia
🥼
🤝
PhD in Chemistry
Lomonosov Moscow State University
7
publications,
60
citations
h
-index:
5
Research interests
Computational chemistry
Machine learning
Quantum Chemistry
Radiochemistry
Sobalev Sergey
🤝
PhD in Chemistry
South Ural State University
Lomonosov Moscow State University
6
publications,
48
citations
h
-index:
3
Research interests
Computational chemistry
Computer simulation
Electronic properties
Non-covalent connections
Quantum Chemistry
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