Martyn F. Guest

发表

Application Performance on High-End and Commodity-class computers

Martyn F. Guest, 2003 .

Large scale electronic structure calculations in the study of the condensed phase

Ian J. Bush, Paul Sherwood, J. H. van Lenthe, 2006 .

The Use of Vector Processors in Quantum Chemistry: Experience in the United Kingdom

Stephen Wilson, Stephen Wilson, Martyn F. Guest, 1981 .

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

David E. Bernholdt, Robert J. Harrison, Ian T. Foster, 1996, Journal of Computational Chemistry.

High Performance Computational Chemistry : ( II ) A Scalable SCFProgramRobert

David E. Bernholdt, Rick A. Kendall, Adrian T. Wong, 1995 .

MC−SCF study of the Diels-Alder reaction between ethylene and butadiene

Martin J. Field, Fernando Bernardi, Michael A. Robb, 1988 .

An ab initio distributed multipole study of the electrostatic potential around an undecapeptide cyclosporin derivative and a comparison with point charge electrostatic models

R. J. Harrison, S. L. Price, Martyn F. Guest, 1989 .

Effect of basis-set completeness on the relative importance of triply and quadruply excited configurations in correlation energy calculations

Stephen Wilson, Stephen Wilson, M. Guest, 1980 .

Analytical potentials for triatomic molecules: VIII. A two-valued surface for the lowest 1A′ states of H2O

Ian M. Mills, S. Carter, M. Guest, 1981 .

QM/MM modelling of the TS-1 catalyst using HPCx

Alexey A. Sokol, Ian J. Bush, Hubertus J. J. van Dam, 2006 .

Computational chemistry on the FPS-X64 scientific computers

Robert J. Harrison, R. Harrison, M. Guest, 1987 .