Synergy of engineering science and digital technologies aimed at the development of a simulation-driven design of advanced materials, structures
Kolesnikov, E.S., Gushchin, I.Y., Zhilyaev, P.A. and Onufriev, A.V., 2021. Journal of Chemical Theory and Computation, 17(11), pp.7246-7259.
DOI: 10.1021/acs.jctc.1c00332
Zhilyaev, P.A., and Korneva, M.A. Physical Chemistry Chemical Physics (2023)
DOI: 10.1039/D3CP01285A
Yasuda, Y., Onishi, R., Hirokawa, Y., Kolomenskiy, D. and Sugiyama, D., Building and Environment 209, 108597, 2022.
DOI:10.1016/j.buildenv.2021.108597