Mike C. Payne

Optimized and transferable nonlocal separable ab initio pseudopotentials.

Heine, Lin, Payne, 1993, Physical review. B, Condensed matter.

Defect energetics in oxide materials from first principles.

Lin, Clarke, Payne, 1992, Physical review letters.

First principles methods using CASTEP

Matt Probert, Chris J. Pickard, Matthew D. Segall, 2005 .

Surface corrugation in the dissociative adsorption of H2 on Cu(100).

White, Payne, Bird, 1994, Physical review letters.

Ground-state properties of CoSi2 determined by a total-energy pseudopotential method.

Mike C. Payne, V. Milman, Ming-Hsien Lee, 1994, Physical review. B, Condensed matter.

First-principles study of a tilt grain boundary in rutile.

Dawson, Lee, Payne, 1996, Physical Review B (Condensed Matter).