2 papers
cond-mat.mtrl-sci2026
The New High-entropy Compound RhMnFeCoGe4 with Cubic Non-centrosymmetric B20 Structure
V. A. Sidorov, V. N. Krasnorussky, A. V. Bokov +8
A novel high-entropy compound, RhMnFeCoGe, with a cubic non-centrosymmetric B20 struc- ture, has been synthesized under conditions of high pressure and temperature. The electri…
cond-mat.mtrl-sci2026
Adaptive fine-tuning of foundation models for crystal structure prediction: Discovery of high-pressure phases in the CaFeNi system
N. M. Chtchelkatchev, M. V. Magnitskaya, R. E. Ryltsev
The prediction of crystal structures is a key challenge in chemistry and materials science, but evolutionary crystal structure prediction (CSP) remains computationally expensive be…