Molybdenum is a newly added material in additive manufacturing material cabinet, and it is under the spotlight owing to its crucial applications. The high-energy electron beam selective melting (EBSM) process is supposed to be a promising technique for molybdenum printing because of its vacuum environment. This paper presents EBSM numerical process simulation for molybdenum on macro-and mesoscale established with exclusive powder material modeling. Experimentally determined, process parameters are implemented in 3D macro-and 2D mesoscale models for a profound process insight. Primarily molybdenum powder material model is established, and a multi-track FEM simulation is performed to predict melt pool configuration, temperature field and phase transformation. Next, powder consolidation mechanism, side surface roughness, porosity, and voids are investigated through a CFD model, where the molybdenum particles are explicitly considered from the EBSM process viewpoint. Results proved the effectiveness of the numerical simulation for detailed EBSM process understanding for molybdenum material.Keywords Additive manufacturing (AM) . Powder bed fusion (PBF) . Electron beam selective melting (EBSM) . Molybdenum material modeling . Finite element method (FEM) . Computational fluid dynamics (CFD)