Integrating the QMR Method with First Principles Material Science Application Code. - Noël M. Nachtigal; William A. Shelton; G. Malcolm Stocks; Donald M. C. Nicholson; Yang Wang 008 (PP, 1995)

Early Experiences With Distributed Supercomputing On I-Way: First Principles Materials Science and Parallel Acoustic Wave Propagation. - George Al Geist II; James Arthur Kohl; Donald M. C. Nicholson; Philip M. Papadopoulos; Bart D. Semeraro; William A. Shelton; G. Malcolm Stocks; Yang Wang 008 (Int. J. High Perform. Comput. Appl., 1996)

Multi-teraflops spin dynamics studies of the magnetic structure of FeMn/Co interfaces. - Andrew Canning; B. Ujfalussy; Thomas C. Schulthess; Xiaoguang Zhang 005; William A. Shelton; Donald M. C. Nicholson; G. Malcolm Stocks; Yang Wang 008; T. Dirks (SC, 2001)

Parallel Multi-Teraflops Studies of the Magnetic Structure of FeMn Alloys. - Andrew Canning; B. Ujfalussy; Thomas C. Schulthess; Xiaoguang Zhang 005; William A. Shelton; Donald M. C. Nicholson; G. Malcolm Stocks; Yang Wang 008; T. Dirks (IPDPS, 2003)

Teraflop Computing for Nanoscience. - Yang Wang 008; G. Malcolm Stocks; Aurelian Rusanu; Donald M. C. Nicholson; Markus Eisenbach 002; J. S. Faulkner (CDES, 2006)

A scalable method for ab initio computation of free energies in nanoscale systems. - Markus Eisenbach 002; C.-G. Zhou; Donald M. C. Nicholson; G. Brown; Jeffrey M. Larkin; Thomas C. Schulthess (SC, 2009)