MD17
Molecular Dynamics 17
홈페이지 · 논문 105편
Energies and forces for molecular dynamics trajectories of eight organic molecules. Level of theory DFT: PBE+vdW-TS.
홈페이지 · 논문 105편
Energies and forces for molecular dynamics trajectories of eight organic molecules. Level of theory DFT: PBE+vdW-TS.