Abstract
A distributed‐memory model is adopted for the development of parallel ab initio codes with an emphasis on portability as well as efficiency. A highly portable message‐passing toolkit (inspired by the Argonne ACRF PARMACS) is described. Examples and results of its use are presented.
| Original language | English |
|---|---|
| Pages (from-to) | 847-863 |
| Number of pages | 17 |
| Journal | International Journal of Quantum Chemistry |
| Volume | 40 |
| Issue number | 6 |
| DOIs | |
| State | Published - Dec 1991 |
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