Research Engineer in computational materials science (RE2)

Job Title

Research Engineer in computational materials science (RE2)

Location

BSC within the CASE Department, Barcelona

Start Date

01/09/2026

Context And Mission

The Materials Science team within the Computer Applications in Software Engineering (CASE) department at the Barcelona Supercomputing Center (BSC) is seeking a highly motivated researcher specialized in computational materials science. This position is part of an international project focused on developing a new generation of porous layered carbon‑nitride photo‑electro‑catalysts for green hydrogen generation, funded by the EU‑LAC Interest Group and fostered by collaboration with leading research institutions in Brazil, Argentina, Austria and Turkey.

Key Duties

• Conduct atomistic simulations to investigate defect stability and catalytic activity in carbon‑nitride compounds.
• Lead the implementation of automated workflows for multiscale an...