Science activity
Articles (1) More info
1 |
Dubok A.S.
, Rychkov D.A.
Deformcell: a python script to simplify and fasten mechanical properties calculations of molecular crystals in VASP package for research and teaching purposes Журнал структурной химии. 2024. DOI: 10.26902/jsc_id132571 OpenAlex |
Conference theses (3) More info
1 |
Dubok A.S.
, Rychkov D.A.
Computational study of mechanical properties of α-pyrazinamide ideal crystal using deformcell python script and VASP software In compilation Горячие точки химии твердого тела: ориентированные фундаментальные исследования [Электронный ресурс] : IV Междунар. конф., посвящ. 80-летию Института химии твердого тела и механохимии СО РАН (2–4 июля 2024 г., Новосибирск, Академгородок): тез. докл. / Ин-т химии тв. тела и механохимии СО РАН. 2024. – C.247. |
2 |
Dubok A.S.
, Rychkov D.A.
Bending Crystal Phenomena: Computational Insight In compilation Physics and Chemistry of Elementary Chemical Processes : Proceedings of the 10th International Voevodsky Conference. September 5–9, 2022. – NSU., 2022. – C.208. – ISBN 978-5-4437-1350-2. |
3 |
Dubok A.S.
, Rychkov D.A.
Bending and Brittle Organic Crystals of Pyrazinamide: A Computational Approach In compilation VI International Conference “Fundamental Bases of Mechanochemical Technologies” : [Electron resource] : FBMT-2022 : [November 21-24, 2022, Novosibirsk, Russia] : Book of abstracts / Institute of Solid State Chemistry and Mechanochemistry SB RAS. 2022. – C.156. |
Conference attendances (4) More info
1 |
Dubok A.S.
, Rychkov D.A.
Computational study of mechanical properties of α-pyrazinamide ideal crystal using deformcell python script and VASP software IV Международная конференция «Горячие точки химии твердого тела: ориентированные фундаментальные исследования» 02-04 Jul 2024 |
2 |
Dubok A.S.
, Rychkov D.A.
Bending and Brittle Organic Crystals of Pyrazinamide: A Computational Approach Fundamental Bases of Mechanochemical Technologies : VI International conference 21-24 Nov 2022 |
3 |
Dubok A.S.
, Rychkov D.A.
Bending Crystal Phenomena: Computational Insight X International Voevodsky Conference "Physics and Chemistry of Elementary Chemical Processes" 05-09 Sep 2022 |
4 |
Dubok A.S.
, Rychkov D.A.
Investigating large anisotropic plasticity of pyrazinamide molecular crystals using computational methods XXIII международная конференция по химической термодинамике в России 22-27 Aug 2022 |
Identifiers
ORCID:
0009-0004-4330-5717