CONUNDrum: A program for orbital-free density functional theory calculations. - Pavlo Golub; Sergei Manzhos (Comput. Phys. Commun., 2020)

Machine learning-guided construction of an analytic kinetic energy functional for orbital free density functional theory. - Sergei Manzhos; Johann Lüder; Pavlo Golub; Manabu Ihara (Mach. Learn. Sci. Technol., 2025)