Published December 13, 2018
| Version v18.0
Software
Open
DIRAC18
Creators
- Saue, T.
- Visscher, L.
- Jensen, H. J. Aa.
- Bast, R.
- Bakken, V.
- Dyall, K. G.
- Dubillard, S.
- Ekström, U.
- Eliav, E.
- Enevoldsen, T.
- Faßhauer, E.
- Fleig, T.
- Fossgaard, O.
- Gomes, A. S. P.
- Hedegård, E. D.
- Helgaker, T.
- 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.
- Shee, A.
- Sikkema, J.
- Thorvaldsen, A. J.
- Thyssen, J.
- van Stralen, J.
- Villaume, S.
- Visser, O.
- Winther, T.
- Yamamoto, S.
Description
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.
Notes
Please join our mailing list: http://groups.google.com/group/dirac-users
Files
Files
(70.3 MB)
| Name | Size | Download all |
|---|---|---|
|
md5:b9f890c629d3d04b82b444ec827a09f1
|
70.3 MB | Download |