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This shows you the differences between two versions of the page.

--- citation [2021/05/26 10:39] – tsaue
+++ citation [2023/02/23 15:25] (current) – tsaue
@@ Line 2: / Line 2: @@
 We recommend citing the employed version (see below) as well as the general paper:
-Trond Saue, Radovan Bast, Andre Severo Pereira Gomes, Hans Jørgen Aagaard Jensen, Lucas Visscher, Ignacio Agustın Aucar, Roberto Di Remigio, Kenneth G. Dyall, 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
+Trond Saue, Radovan Bast, Andre Severo Pereira Gomes, Hans Jørgen Aagaard Jensen, Lucas Visscher, Ignacio Agustín Aucar, Roberto Di Remigio, Kenneth G. Dyall, 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
 ----
+==== DIRAC23 ====
+DIRAC, a relativistic ab initio electronic structure program,
+Release DIRAC23 (2023),
+written by R. Bast, A. S. P. Gomes, T. Saue and L. Visscher and H. J. Aa. Jensen,
+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, A. Nyvang,
+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 https://doi.org/10.5281/zenodo.7670749, see also https://www.diracprogram.org).
+bibtex entry:
+  @Misc{DIRAC23,
+        note = "{DIRAC}, a relativistic ab initio electronic structure program,
+        Release {DIRAC23} (2023),
+        written by R.~Bast, A.~S.~P.~Gomes, T.~Saue and L.~Visscher and H.~J.~{\relax Aa}.~Jensen,
+        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, A.~Nyvang, 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{https://doi.org/10.5281/zenodo.7670749},
+        see also  \url{https://www.diracprogram.org})"}
+--------
+==== 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 ====
@@ Line 10: / Line 83: @@
 DIRAC, a relativistic ab initio electronic structure program,
 Release DIRAC21 (2021),
-written by A. S. P. Gomes, T. Saue, L. Visscher, H. J. Aa. Jensen, and R. Bast,
+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,
@@ Line 16: / Line 89: @@
 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,
+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, Y. C. Park, J. K. Pedersen, M. Pernpointner,
+G. Olejniczak, J. Olsen, J. M. H. Olsen, A. Papadopoulos, Y. C. Park, J. K. Pedersen, M. Pernpointner,
-R. Di Remigio, K. Ruud, P. Sałek, B. Schimmelpfennig, B. Senjean, A. Shee, J. Sikkema,
+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.3572669, see also http://www.diracprogram.org).
+T. Winther, and S. Yamamoto (available at http://dx.doi.org/10.5281/zenodo.4836496, see also http://www.diracprogram.org).
 bibtex entry:
-  @Misc{DIRAC19,
+  @Misc{DIRAC21,
         note = "{DIRAC}, a relativistic ab initio electronic structure program,
-        Release {DIRAC19} (2019),
+        Release {DIRAC21} (2021),
-        written by A.~S.~P.~Gomes, T.~Saue, L.~Visscher, H.~J.~{\relax Aa}.~Jensen, and R.~Bast,
+        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, B.~Heimlich--Paris, T.~Helgaker, J.~Henriksson, M.~Ilia{\v{s}},
+        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, H.~S.~Nataraj, M.~K.~Nayak, P.~Norman, G.~Olejniczak, J.~Olsen, J.~M.~H.~Olsen,
+        Y.~S.~Lee, N.~H.~List, H.~S.~Nataraj, M.~K.~Nayak, P.~Norman, G.~Olejniczak,
-        Y.~C.~Park, J.~K.~Pedersen, M.~Pernpointner, R.~di~Remigio, K.~Ruud, P.~Sa{\l}ek,
+        J.~Olsen, J.~M.~H.~Olsen, A.~Papadopoulos, Y.~C.~Park, J.~K.~Pedersen, M.~Pernpointner,
-        B.~Schimmelpfennig, B.~Senjean, A.~Shee, J.~Sikkema, A.~J.~Thorvaldsen, J.~Thyssen,
+        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.3572669},
+        (available at \url{http://dx.doi.org/10.5281/zenodo.4836496},
         see also  \url{http://www.diracprogram.org})"}