Software Open Access
DIRAC19
Gomes, A. S. P.; Saue, T.; Visscher, L.; Jensen, H. J. Aa.; Bast, R.; Aucar, I. A.; Bakken, V.; Dyall, K. G.; Dubillard, S.; Ekström, U.; Eliav, E.; Enevoldsen, T.; Faßhauer, E.; Fleig, T.; Fossgaard, O.; Halbert, L.; Hedegård, E. D.; Helgaker, T.; Helmich-Paris, B.; Henriksson, J.; Iliaš, M.; Jacob, Ch. R.; Knecht, S.; Komorovský, S.; Kullie, O.; Lærdahl, J. K.; Larsen, C. V.; Lee, Y. S.; Nataraj, H. S.; Nayak, M. K.; Norman, P.; Olejniczak, G.; Olsen, J.; Olsen, J. M. H.; Park, Y. C.; Pedersen, J. K.; Pernpointner, M.; Di Remigio, R.; Ruud, K.; Sałek, P.; Schimmelpfennig, B.; Senjean, B.; Shee, A.; Sikkema, J.; Thorvaldsen, A. J.; Thyssen, J.; van Stralen, J.; Vidal, M. L.; Villaume, S.; Visser, O.; Winther, T.; Yamamoto, S.
DIRAC: Program for Atomic and Molecular Direct Iterative Relativistic All-electron Calculations.
Project website: http://diracprogram.org
The DIRAC program computes molecular properties using relativistic quantum chemical methods. It is named after P.A.M. Dirac, the father of relativistic electronic structure theory.
| Name | Size | |
|---|---|---|
|
DIRAC-19.0-Source.tar.gz
md5:3d20769fb79c72e89e38b1a21035c6fa |
77.8 MB | Download |
| All versions | This version | |
|---|---|---|
| Views | 1,420 | 1,417 |
| Downloads | 1,087 | 1,089 |
| Data volume | 84.6 GB | 84.8 GB |
| Unique views | 1,177 | 1,174 |
| Unique downloads | 770 | 772 |
- Publication date:
- December 12, 2019
- DOI:
-
- License (for files):
- Other (Not Open)