Parallel computation of second derivatives of RHF energy on distributed memory computers
Version of Record online: 7 DEC 1998
Copyright © 1997 John Wiley & Sons, Inc.
Journal of Computational Chemistry
Volume 18, Issue 2, pages 159–168, 30 January 1997
How to Cite
Márquez, A. M., Oviedo, J., Sanz, J. F. and Dupuis, M. (1997), Parallel computation of second derivatives of RHF energy on distributed memory computers. J. Comput. Chem., 18: 159–168. doi: 10.1002/(SICI)1096-987X(19970130)18:2<159::AID-JCC2>3.0.CO;2-U
- Issue online: 7 DEC 1998
- Version of Record online: 7 DEC 1998
- Manuscript Accepted: 3 MAY 1996
- Manuscript Received: 16 JUN 1995
- Convex Supercomputer SAE
- Dirección General Cientifica y Tecnica. Grant Number: PB92-0662
- IBM Corp.. Grant Number: University Agreement MHVU4802
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