Stochastic simulation of electron transport in a strong electrical field in low-dimensional heterostructures. - Evgenia Kablukova; Karl K. Sabelfeld; Dmitry Protasov; Konstantin S. Zhuravlev (Monte Carlo Methods Appl., 2023)

$ nabla^2$DFT: A Universal Quantum Chemistry Dataset of Drug-Like Molecules and a Benchmark for Neural Network Potentials. - Kuzma Khrabrov; Anton Ber; Artem Tsypin; Konstantin Ushenin; Egor Rumiantsev; Alexander Telepov; Dmitry Protasov; Ilya Shenbin; Anton Alekseev 001; Mikhail Shirokikh; Sergey I. Nikolenko; Elena Tutubalina; et al. (NeurIPS, 2024)

∇2DFT: A Universal Quantum Chemistry Dataset of Drug-Like Molecules and a Benchmark for Neural Network Potentials. - Kuzma Khrabrov; Anton Ber; Artem Tsypin; Konstantin Ushenin; Egor Rumiantsev; Alexander Telepov; Dmitry Protasov; Ilya Shenbin; Anton Alekseev 001; Mikhail Shirokikh; Sergey I. Nikolenko; Elena Tutubalina; et al. (CoRR, 2024)