Dalton (program) explained

Dalton
Released:1983
Latest Release Version:2020
Latest Release Date:[1]
Programming Language:Fortran
Operating System:Linux
Genre:Ab initio quantum chemistry methods, Density functional theory
License:GNU Lesser General Public License

Dalton (named after John Dalton) is an ab initio quantum chemistry computer program suite, consisting of the Dalton and LSDalton programs.[2] The Dalton suite is capable of calculating various molecular properties using the Hartree - Fock, MP2, MCSCF and coupled cluster theories. Version 2.0 of DALTON added support for density functional theory calculations. There are many authors, including Trygve Helgaker, Poul Jørgensen and Kenneth Ruud.

Dalton switched to the open source GNU LGPL licence in August 2017.

See also

External links

Notes and References

  1. Web site: Dalton release history . 2019-11-28.
  2. Aidas. Kestutis. Angeli. Celestino. Bak. Keld L.. Bakken. Vebjørn. Bast. Radovan. Boman. Linus. Christiansen. Ove. Cimiraglia. Renzo. Coriani. Sonia. Dahle. Pål. Dalskov. Erik K.. Ekström. Ulf. Enevoldsen. Thomas. Eriksen. Janus J.. Ettenhuber. Patrick. Fernández. Berta. Ferrighi. Lara. Fliegl. Heike. Frediani. Luca. Hald. Kasper. Halkier. Asger. Hättig. Christof. Heiberg. Hanne. Helgaker. Trygve. Hennum. Alf Christian. Hettema. Hinne. Hjertenæs. Eirik. Høst. Stinne. Høyvik. Ida-Marie. Iozzi. Maria Francesca. Jansík. Branislav. Jensen. Hans Jørgen Aa.. Jonsson. Dan. Jørgensen. Poul. Kauczor. Joanna. Kirpekar. Sheela. Kjærgaard. Thomas. Klopper. Wim. Knecht. Stefan. Kobayashi. Rika. Koch. Henrik. Kongsted. Jacob. Krapp. Andreas. Kristensen. Kasper. Ligabue. Andrea. Lutnæs. Ola B.. Melo. Juan I.. Mikkelsen. Kurt V.. Myhre. Rolf H.. Neiss. Christian. Nielsen. Christian B.. Normal. Patrick. Olsen. Jeppe. Olsen. Jógvan Magnus H.. Osted. Anders. Packer. Martin J.. Pawlowski. Filip. Pedersen. Thomas B.. Provasi. Patricio F.. Reine. Simen. Rinkevicius. Zilvinas. Ruden. Torgeir A.. Ruud. Kenneth. Rybkin. Vladimir V.. Sałek. Pawel. Samson. Claire C. M.. de Merás. Alfredo Sánchez. Saue. Trond. Sauer. Stephan P. A.. Schimmelpfennig. Bernd. Sneskov. Kristian. Steindal. Arnfinn H.. Sylvester-Hvid. Kristian O.. Taylor. Peter R.. Teale. Andrew M.. Tellgren. Erik I.. Tew. David P.. Thorvaldsen. Andreas J.. Thøgersen. Lea. Vahtras. Olav. Watson. Mark A.. Wilson. David J. D.. Ziolkowski. Marcin. Ågren. Hans. 1. The Dalton quantum chemistry program system. Wiley Interdisciplinary Reviews: Computational Molecular Science. 2014. 4. 3. 269–284. 10.1002/wcms.1172. 25309629. 4171759.