The CGTO integral evaluation, SCF, SCF-gradient, integral transformation, and MR-CI (SD) steps of the COLUMBUS system of programs have been adapted for the CYBER 205. A description is given of our efforts and the partly heavy modifications necessary to exploit the potential of this supercomputer and
Implementation of a macromolecular mechanics program on a cyber 205 supercomputer
β Scribed by Steven L. Gallion; Ronald M. Levy; Paul K. Weiner; Fumio Hirata
- Publisher
- Elsevier Science
- Year
- 1986
- Tongue
- English
- Weight
- 711 KB
- Volume
- 10
- Category
- Article
- ISSN
- 0097-8485
No coin nor oath required. For personal study only.
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