Toward high-performance computational chemistry: II. A scalable self-consistent field program.

Robert J. Harrison Martyn F. Guest Ricky A. Kendall David E. Bernholdt Adrian T. Wong Mark Stave James L. Anchell Anthony C. Hess Rik J. Littlefield George L. Fann Jarek Nieplocha Greg S. Thomas David Elwood Jeffrey L. Tilson Ron L. Shepard Albert F. Wagner Ian T. Foster Ewing L. Lusk Rick Stevens Toward high-performance computational chemistry: II. A scalable self-consistent field program. 124-132 1996 17 Journal of Computational Chemistry 1 http://dx.doi.org/10.1002/(SICI)1096-987X(19960115)17:1<124::AID-JCC10>3.0.CO;2 db/journals/jcc/jcc17.html#HarrisonGKBWSAHLFNTETSWFLS96