skill

Theory of Quantum Mechanics/Molecular Mechanics (KM/MM)

Sorokin Pavel
🥼 🤝
DSc in Physics and Mathematics, Associate Professor
MISiS
MISiS
184 publications,  6 749 citations
h-index: 36
Skills
Maintenance of technical documentation
Quantum molecular dynamics
Quantum Chemistry
Molecular dynamics and quantum chemical calculations
Theory of Quantum Mechanics/Molecular Mechanics (KM/MM)
Hartree - Foca (HF)
Maltlab
DFT calculations
CorelDraw
Research Management
VASP
Ab initio calculations
LAMMPS
Web of Science
Condensed matter theory
English
Editing scientific articles
Molecular dynamics
Quantum Espresso
SIESTA
Bochenkova Anastasia
🥼
PhD in Physics and Mathematics, Associate Professor
MSU
MSU
69 publications,  1 031 citations
h-index: 19
Skills
Quantum molecular dynamics
Quantum Chemistry
Theory of Quantum Mechanics/Molecular Mechanics (KM/MM)
Programming
Neilo Aleksey
MSU
MSU
6 publications,  11 citations
h-index: 2
Skills
Quantum molecular dynamics
Molecular dynamics and quantum chemical calculations
Theory of Quantum Mechanics/Molecular Mechanics (KM/MM)
C
C++
Maltlab
OriginLab
Mathematica
DFT calculations
Soldering
Fedorenko Olga
🤝
MSU
MSU
h-index: 0
Skills
Quantum molecular dynamics
Quantum Chemistry
Machine Learning
Molecular dynamics and quantum chemical calculations
Theory of Quantum Mechanics/Molecular Mechanics (KM/MM)
Bash
Pascal
Python
Fortran
Ab initio calculations