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citation [2018/12/10 17:14] tsauecitation [2022/02/08 15:10] tsaue
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-We work long days and late nights to improve the DIRAC code which we distribute free of charge. We therefore ask you to acknowledge any use of the DIRAC program suite that results in published material using one of the following citations (depending on the employed version of DIRAC).+We work long days and late nights to improve the DIRAC code which we distribute free of charge. We therefore ask you to acknowledge any use of the DIRAC program suite that results in published material
 +We recommend citing the employed version (see belowas well as the general paper: 
 + 
 +Trond Saue, Radovan Bast, Andre Severo Pereira Gomes, Hans Jørgen Aagaard Jensen, Lucas Visscher, Ignacio Agustín Aucar, Roberto Di Remigio, Kenneth GDyall, Ephraim Eliav, Elke Faßhauer, Timo Fleig, Loıc Halbert, Erik Donovan Hedegård, Benjamin Helmich-Paris, Miroslav Iliaš, Christoph R. Jacob, Stefan Knecht, Jon K Laerdahl, Marta L. Vidal, Malaya K Nayak, Małgorzata Olejniczak, Jógvan Magnus Haugaard Olsen, Markus Pernpointner, Bruno Senjean, Avijit Shee, Ayaki Sunaga, Joost N. P. van Stralen, [[https://doi.org/10.1063/5.0004844|J. Chem. Phys.]] 152 (2020) 204104 
  
 ---- ----
 +
 +==== DIRAC22 ====
 +
 +DIRAC, a relativistic ab initio electronic structure program,
 +Release DIRAC22 (2022),
 +written by H. J. Aa. Jensen, R. Bast, A. S. P. Gomes, T. Saue and L. Visscher, 
 +with contributions from I. A. Aucar, V. Bakken, C. Chibueze, J. Creutzberg, K. G. Dyall, S. Dubillard,
 +U. Ekström, E. Eliav, T. Enevoldsen, E. Faßhauer, T. Fleig,
 +O. Fossgaard, L. Halbert, E. D. Hedegård, 
 +T. Helgaker,  B. Helmich-Paris, J. Henriksson, M. van Horn, M. Iliaš,
 +Ch. R. Jacob, S. Knecht, S. Komorovský, O. Kullie, J. K. Lærdahl,
 +C. V. Larsen, Y. S. Lee, N. H. List, H. S. Nataraj, M. K. Nayak, P. Norman,
 +G. Olejniczak, J. Olsen, J. M. H. Olsen, A. Papadopoulos, Y. C. Park, J. K. Pedersen, M. Pernpointner,
 +J. V. Pototschnig, R. Di Remigio, M. Repisky, K. Ruud, P. Sałek, B. Schimmelpfennig, B. Senjean, A. Shee, J. Sikkema, A. Sunaga, 
 +A. J. Thorvaldsen, J. Thyssen, J. van Stralen, M. L. Vidal, S. Villaume, O. Visser,
 +T. Winther, S. Yamamoto and X. Yuan (available at http://dx.doi.org/10.5281/zenodo.6010450, see also http://www.diracprogram.org).
 +
 +
 +bibtex entry:
 +  @Misc{DIRAC22,
 +        note = "{DIRAC}, a relativistic ab initio electronic structure program,
 +        Release {DIRAC22} (2022),
 +        written by H.~J.~{\relax Aa}.~Jensen, R.~Bast, A.~S.~P.~Gomes, T.~Saue and L.~Visscher,   
 +        with contributions from I.~A.~Aucar, V.~Bakken, C.~Chibueze, J.~Creutzberg, K.~G.~Dyall, 
 +        S.~Dubillard, U.~Ekstr{\"o}m, E.~Eliav, T.~Enevoldsen, E.~Fa{\ss}hauer, T.~Fleig, O.~Fossgaard, 
 +        L.~Halbert, E.~D.~Hedeg{\aa}rd, T.~Helgaker, B.~Helmich--Paris, J.~Henriksson, M.~van~Horn, 
 +        M.~Ilia{\v{s}}, Ch.~R.~Jacob, S.~Knecht, S.~Komorovsk{\'y}, O.~Kullie, J.~K.~L{\ae}rdahl, C.~V.~Larsen, 
 +        Y.~S.~Lee, N.~H.~List, H.~S.~Nataraj, M.~K.~Nayak, P.~Norman, G.~Olejniczak, 
 +        J.~Olsen, J.~M.~H.~Olsen, A.~Papadopoulos, Y.~C.~Park, J.~K.~Pedersen, M.~Pernpointner,
 +        J.~V.~Pototschnig, R.~di~Remigio, M.~Repisky, K.~Ruud, P.~Sa{\l}ek, B.~Schimmelpfennig, 
 +        B.~Senjean, A.~Shee, J.~Sikkema, A.~Sunaga, A.~J.~Thorvaldsen, J.~Thyssen, 
 +        J.~van~Stralen, M.~L.~Vidal, S.~Villaume, O.~Visser, T.~Winther, S.~Yamamoto and X.~Yuan
 +        (available at \url{http://dx.doi.org/10.5281/zenodo.6010450}, 
 +        see also  \url{http://www.diracprogram.org})"}
 +
 +--------
 +
 +==== DIRAC21 ====
 +
 +DIRAC, a relativistic ab initio electronic structure program,
 +Release DIRAC21 (2021),
 +written by R. Bast, A. S. P. Gomes, T. Saue, L. Visscher, and H. J. Aa. Jensen, 
 +with contributions from I. A. Aucar, V. Bakken, K. G. Dyall, S. Dubillard,
 +U. Ekström, E. Eliav, T. Enevoldsen, E. Faßhauer, T. Fleig,
 +O. Fossgaard, L. Halbert, E. D. Hedegård, 
 +T. Helgaker,  B. Helmich-Paris, J. Henriksson, M. Iliaš,
 +Ch. R. Jacob, S. Knecht, S. Komorovský, O. Kullie, J. K. Lærdahl,
 +C. V. Larsen, Y. S. Lee, N. H. List, H. S. Nataraj, M. K. Nayak, P. Norman,
 +G. Olejniczak, J. Olsen, J. M. H. Olsen, A. Papadopoulos, Y. C. Park, J. K. Pedersen, M. Pernpointner,
 +J. V. Pototschnig, R. Di Remigio, M. Repisky, K. Ruud, P. Sałek, B. Schimmelpfennig, B. Senjean, A. Shee, J. Sikkema, A. Sunaga, 
 +A. J. Thorvaldsen, J. Thyssen, J. van Stralen, M. L. Vidal, S. Villaume, O. Visser,
 +T. Winther, and S. Yamamoto (available at http://dx.doi.org/10.5281/zenodo.4836496, see also http://www.diracprogram.org).
 +
 +
 +bibtex entry:
 +  @Misc{DIRAC21,
 +        note = "{DIRAC}, a relativistic ab initio electronic structure program,
 +        Release {DIRAC21} (2021),
 +        written by R.~Bast, A.~S.~P.~Gomes, T.~Saue, L.~Visscher, and H.~J.~{\relax Aa}.~Jensen,  
 +        with contributions from I.~A.~Aucar, V.~Bakken, K.~G.~Dyall, S.~Dubillard, U.~Ekstr{\"o}m, 
 +        E.~Eliav, T.~Enevoldsen, E.~Fa{\ss}hauer, T.~Fleig, O.~Fossgaard, L.~Halbert, 
 +        E.~D.~Hedeg{\aa}rd, T.~Helgaker, B.~Helmich--Paris, J.~Henriksson, M.~Ilia{\v{s}},  
 +        Ch.~R.~Jacob, S.~Knecht, S.~Komorovsk{\'y}, O.~Kullie, J.~K.~L{\ae}rdahl, C.~V.~Larsen, 
 +        Y.~S.~Lee, N.~H.~List, H.~S.~Nataraj, M.~K.~Nayak, P.~Norman, G.~Olejniczak, 
 +        J.~Olsen, J.~M.~H.~Olsen, A.~Papadopoulos, Y.~C.~Park, J.~K.~Pedersen, M.~Pernpointner,
 +        J.~V.~Pototschnig, R.~di~Remigio, M.~Repisky, K.~Ruud, P.~Sa{\l}ek, B.~Schimmelpfennig, 
 +        B.~Senjean, A.~Shee, J.~Sikkema, A.~Sunaga, A.~J.~Thorvaldsen, J.~Thyssen, 
 +        J.~van~Stralen, M.~L.~Vidal, S.~Villaume, O.~Visser, T.~Winther, and S.~Yamamoto 
 +        (available at \url{http://dx.doi.org/10.5281/zenodo.4836496}, 
 +        see also  \url{http://www.diracprogram.org})"}
 +
 +----
 +
 +==== DIRAC19 ====
 +
 +DIRAC, a relativistic ab initio electronic structure program,
 +Release DIRAC19 (2019),
 +written by A. S. P. Gomes, T. Saue, L. Visscher, H. J. Aa. Jensen, and R. Bast,
 +with contributions from I. A. Aucar, V. Bakken, K. G. Dyall, S. Dubillard,
 +U. Ekström, E. Eliav, T. Enevoldsen, E. Faßhauer, T. Fleig,
 +O. Fossgaard, L. Halbert, E. D. Hedegård, 
 +T. Helgaker,  B. Helmich-Paris, J. Henriksson, M. Iliaš,
 +Ch. R. Jacob, S. Knecht, S. Komorovský, O. Kullie, J. K. Lærdahl,
 +C. V. Larsen, Y. S. Lee, H. S. Nataraj, M. K. Nayak, P. Norman,
 +G. Olejniczak, J. Olsen, J. M. H. Olsen, Y. C. Park, J. K. Pedersen, M. Pernpointner,
 +R. Di Remigio, K. Ruud, P. Sałek, B. Schimmelpfennig, B. Senjean, A. Shee, J. Sikkema,
 +A. J. Thorvaldsen, J. Thyssen, J. van Stralen, M. L. Vidal, S. Villaume, O. Visser,
 +T. Winther, and S. Yamamoto (available at http://dx.doi.org/10.5281/zenodo.3572669, see also http://www.diracprogram.org).
 +
 +
 +bibtex entry:
 +  @Misc{DIRAC19,
 +        note = "{DIRAC}, a relativistic ab initio electronic structure program,
 +        Release {DIRAC19} (2019),
 +        written by A.~S.~P.~Gomes, T.~Saue, L.~Visscher, H.~J.~{\relax Aa}.~Jensen, and R.~Bast, 
 +        with contributions from I.~A.~Aucar, V.~Bakken, K.~G.~Dyall, S.~Dubillard, U.~Ekstr{\"o}m, 
 +        E.~Eliav, T.~Enevoldsen, E.~Fa{\ss}hauer, T.~Fleig, O.~Fossgaard, L.~Halbert, 
 +        E.~D.~Hedeg{\aa}rd, B.~Heimlich--Paris, T.~Helgaker, J.~Henriksson, M.~Ilia{\v{s}},  
 +        Ch.~R.~Jacob, S.~Knecht, S.~Komorovsk{\'y}, O.~Kullie, J.~K.~L{\ae}rdahl, C.~V.~Larsen, 
 +        Y.~S.~Lee, H.~S.~Nataraj, M.~K.~Nayak, P.~Norman, G.~Olejniczak, J.~Olsen, J.~M.~H.~Olsen,
 +        Y.~C.~Park, J.~K.~Pedersen, M.~Pernpointner, R.~di~Remigio, K.~Ruud, P.~Sa{\l}ek, 
 +        B.~Schimmelpfennig, B.~Senjean, A.~Shee, J.~Sikkema, A.~J.~Thorvaldsen, J.~Thyssen, 
 +        J.~van~Stralen, M.~L.~Vidal, S.~Villaume, O.~Visser, T.~Winther, and S.~Yamamoto 
 +        (available at \url{http://dx.doi.org/10.5281/zenodo.3572669}, 
 +        see also  \url{http://www.diracprogram.org})"}
 +
 +----
 +
  
 ==== DIRAC18 ==== ==== DIRAC18 ====
  
 DIRAC, a relativistic ab initio electronic structure program, DIRAC, a relativistic ab initio electronic structure program,
-Release DIRAC17 (2018),+Release DIRAC18 (2018),
 written by T. Saue, L. Visscher, H. J. Aa. Jensen, and R. Bast, written by T. Saue, L. Visscher, H. J. Aa. Jensen, and R. Bast,
 with contributions from V. Bakken, K. G. Dyall, S. Dubillard, with contributions from V. Bakken, K. G. Dyall, S. Dubillard,
Line 16: Line 127:
 R. Di Remigio, K. Ruud, P. Sałek, B. Schimmelpfennig, A. Shee, J. Sikkema, R. Di Remigio, K. Ruud, P. Sałek, B. Schimmelpfennig, A. Shee, J. Sikkema,
 A. J. Thorvaldsen, J. Thyssen, J. van Stralen, S. Villaume, O. Visser, A. J. Thorvaldsen, J. Thyssen, J. van Stralen, S. Villaume, O. Visser,
-T. Winther, and S. Yamamoto (see http://www.diracprogram.org).+T. Winther, and S. Yamamoto (available at https://doi.org/10.5281/zenodo.2253986, see also http://www.diracprogram.org).
  
  
Line 31: Line 142:
         J.~K.~Pedersen, M.~Pernpointner, R.~di~Remigio, K.~Ruud, P.~Sa{\l}ek, B.~Schimmelpfennig,          J.~K.~Pedersen, M.~Pernpointner, R.~di~Remigio, K.~Ruud, P.~Sa{\l}ek, B.~Schimmelpfennig, 
         A.~Shee, J.~Sikkema, A.~J.~Thorvaldsen, J.~Thyssen, J.~van~Stralen, S.~Villaume, O.~Visser,          A.~Shee, J.~Sikkema, A.~J.~Thorvaldsen, J.~Thyssen, J.~van~Stralen, S.~Villaume, O.~Visser, 
-        T.~Winther, and S.~Yamamoto (see \url{http://www.diracprogram.org})"}+        T.~Winther, and S.~Yamamoto (available at \url{https://doi.org/10.5281/zenodo.2253986},  
 +        see also  \url{http://www.diracprogram.org})"}
  
 ---- ----
citation.txt · Last modified: 2024/02/21 15:32 by tsaue

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