Title
A Beowulf Cluster for Computational Chemistry
Abstract
We have constructed a Beowulf cluster of networked PCs that is dedicated to solving chemistry problems using standard software packages such as Gaussian and GAMESS. We describe the economic and performance trade-offs in the design of the cluster, and present some some selected benchmark results for a parallel version of GAMESS. We believe that the Beowulf we have constructed offers the best price/performance ratio for our chemistry applications, and that commodity clusters can now provide dedicated supercomputer performance within the budget of most university departments.
Year
DOI
Venue
2000
10.1007/3-540-45492-6_55
HPCN Europe
Keywords
Field
DocType
supercomputer performance,networked pcs,chemistry application,performance trade-offs,best price,chemistry problem,beowulf cluster,computational chemistry,commodity cluster,performance ratio,parallel version
Cluster (physics),Supercomputer,Performance ratio,Computer science,Parallel computing,Computational science,Gaussian,Software,Systems architecture,GAMESS
Conference
Volume
ISSN
ISBN
1823
0302-9743
3-540-67553-1
Citations 
PageRank 
References 
0
0.34
2
Authors
5
Name
Order
Citations
PageRank
K. A. Hawick129366.26
D. A. Grove24014.18
Paul D. Coddington325933.09
H. A. James48931.57
M. A. Buntine510.77