Density functional study of 3d-transition metal aluminides

• Main Authors: Ouyang, Y., Wang, J., Liu, F., Liu, Y., Du, Y., He, Y., Feng, Y.
• Other Authors: PHYSICS
• Format: Article
• Published: 2014
• Subjects: Dimer; First-principles; Spectroscopic constant; Transition metal aluminides
• Online Access: http://scholarbank.nus.edu.sg/handle/10635/96163
• Institution: National University of Singapore

10.1016/j.theochem.2009.03.018