TY - GEN AU - Canca López, Pablo AU - Fu, Chu-Chun AU - Ortiz, Christophe AU - Biel Ruiz, Blanca PY - 2025 UR - https://hdl.handle.net/10481/105272 AB - Understanding the atomic structure and energetic stability of ferrite–cementite interfaces is essential for opti- mising the mechanical performance of steels, especially under extreme conditions such as those encountered in nuclear fusion... LA - eng KW - DFT KW - MD KW - Fe KW - Interfaces KW - Bagaryatskii KW - Cementite TI - A Combined DFT and MD Study on Interface Stability in Ferrite-Cementite Systems DO - 10.1016/j.actamat.2025.121157 ER -