G. Will, N. Masciocchi, et al.
Zeitschrift fur Kristallographie - New Crystal Structures
We present the results of extensive numerical experiments designed to test the ability of the local-density theory of electronic exchange and correlation to describe binding in both simple and transition metals. Predicted nuclear separations, cohesive energies, and bulk moduli for 26 third- and fourth-row metals exhibit remarkable agreement with experiment. The only input to these calculations is the atomic number. © 1977 The American Physical Society.
G. Will, N. Masciocchi, et al.
Zeitschrift fur Kristallographie - New Crystal Structures
David B. Mitzi
Journal of Materials Chemistry
Hiroshi Ito, Reinhold Schwalm
JES
Robert W. Keyes
Physical Review B