Huang, L.; Cao, T.; Gong, P.; Zeng, Z.: Isotope effects on the vibrational, Invar, and Elinvar properties of pristine and hydrogenated graphene. Solid State Communications 190, pp. 5 - 9 (2014)
International research team shows how hydrogen affects Nickel-base superalloys at elevated temperatures. Latest results published in journal Nature Materials.
In this project we study a new strategy for the theory-guided bottom up design of beta-Ti alloys for biomedical applications using a quantum mechanical approach in conjunction with experiments. Parameter-free density functional theory calculations are used to provide theoretical guidance in selecting and optimizing Ti-based alloys...