Acceleration of the GAMESS-UK electronic structure package on graphical processing units. - Karl A. Wilkinson; Paul Sherwood; Martyn F. Guest; Kevin J. Naidoo (J. Comput. Chem., 2011)

Porting ONETEP to graphical processing unit-based coprocessors. 1. FFT box operations. - Karl A. Wilkinson; Chris-Kriton Skylaris (J. Comput. Chem., 2013)

Generating Optimized Fourier Interpolation Routines for Density Functional Theory Using SPIRAL. - Doru-Thom Popovici; Francis P. Russell; Karl A. Wilkinson; Chris-Kriton Skylaris; Paul H. J. Kelly; Franz Franchetti (IPDPS, 2015)

Optimised three-dimensional Fourier interpolation: An analysis of techniques and application to a linear-scaling density functional theory code. - Francis P. Russell; Karl A. Wilkinson; Paul H. J. Kelly; Chris-Kriton Skylaris (Comput. Phys. Commun., 2015)