Published May 28, 2021
| Version v21.0
Software
Open
DIRAC21
Creators
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Bast, R.
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Gomes, A. S. P.
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Saue, T.
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Visscher, L.
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Jensen, H. J. Aa.
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Aucar, I. A.
- Bakken, V.
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Dyall, K. G.
- Dubillard, S.
- Ekström, U.
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Eliav, E.
- Enevoldsen, T.
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Faßhauer, E.
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Fleig, T.
- Fossgaard, O.
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Halbert, L.
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Hedegård, E. D.
- Helgaker, T.
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Helmich-Paris, B.
- Henriksson, J.
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Iliaš, M.
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Jacob, Ch. R.
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Knecht, S.
- Komorovský, S.
- Kullie, O.
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Lærdahl, J. K.
- Larsen, C. V.
- Lee, Y. S.
- List, N. H.
- Nataraj, H. S.
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Nayak, M. K.
- Norman, P.
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Olejniczak, G.
- Olsen, J.
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Olsen, J. M. H.
- Papadopoulos, A.
- Park, Y. C.
- Pedersen, J. K.
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Pernpointner, M.
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Pototschnig, J. V.
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Di Remigio, R.
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Repiský, M.
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Ruud, K.
- Sałek, P.
- Schimmelpfennig, B.
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Senjean, B.
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Shee, A.
- Sikkema, J.
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Sunaga, A.
- Thorvaldsen, A. J.
- Thyssen, J.
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van Stralen, J.
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Vidal, M. L.
- 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
Files
Files
(165.0 MB)
Name | Size | Download all |
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md5:71b154016f70f8b7cdb9f67019cb033a
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82.5 MB | Download |
md5:312abbd6e48e297ef289bf421c7bcd00
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82.5 MB | Download |