ABACUS version 2.1.0 is available for download! Compared to ABACUS v2.0.0, the Real-time time dependent density functional theory (TDDFT), the Electrostatic potential, the Mulliken charge, and the Projected density of states (PDOS) are newly added features in ABACUS 2.1.0. Other functionalities including hybrid density functionals and spin-orbital coupling are under active development, and will be available in the future releases. In addition, the computational performance and parallel scalability in this version has been greatly improved. It is now easy to process material systems of thousands of atoms, with or without a vacuum layer, with just tens or hundreds of cores. You can click abacus_manual_v2.1.0.pdf to download the user’s guide for this version. ABACUS_v2.1.0.tar.gz (updated on 2020.12.10) |