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--- start [2019/02/05 11:14] – update my email address bast
+++ start [2020/05/28 10:06] – aspg
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 It is named after P.A.M. Dirac, the father of relativistic electronic structure theory.
-Get the latest DIRAC version here (**open access**): [[https://doi.org/10.5281/zenodo.2253986|{{:marketing:download-button.png|Download the latest version}}]]
+Get the latest DIRAC version here (**open access**): [[https://doi.org/10.5281/zenodo.3572669|{{:marketing:download-button.png|Download the latest version}}]]
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 ===== News =====
+-04-10 New paper: Susi Lehtola, Lucas Visscher, Eberhard Engel: //Efficient implementation of the superposition of atomic potentials initial guess for electronic structure calculations in Gaussian basis sets//, J. Chem. Phys. 152 (2020) 144105 [[ https://doi.org/10.1063/5.0004046|(electronic version)]])
+-01-20 New paper: Nanna Holmgaard List, Timothé Romain Léo Melin, Martin van Horn and Trond Saue: //Beyond the electric-dipole approximation in simulations of X-ray absorption spectroscopy: Lessons from relativistic theory//, J. Chem. Phys. 152 (2020) 184110 [[ https://doi.org/10.1063/5.0003103 |(electronic version)]] [[ https://arxiv.org/abs/2001.10738|(arXiv)]])
+-03-11 New paper : Loic Halbert, Malgorzata Olejniczak, Valerie Vallet and Andre Severo Pereira Gomes : //
+Investigating solvent effects on the magnetic properties of molybdate ions (MoO<sub>4</sub><sup>2−</sup>) with relativistic embedding//, International Journal of Quantum Chemistry (2020) e26207 [[https://doi.org/10.1002/qua.26207|(electronic version)]] [[https://arxiv.org/abs/1912.06192|(arXiv)]]
+-03-06 New paper : Malgorzata Olejniczak, Andre Severo Pereira Gomes and Julien Tierny : //
+A Topological Data Analysis perspective on noncovalent interactions in relativistic calculations//, International Journal of Quantum Chemistry 120 (2020) e26133 [[https://doi.org/10.1002/qua.26133|(electronic version)]] [[https://arxiv.org/abs/1908.00911|(arXiv)]]
+{{ :news:qua.v120.8.cover.jpg?nolink&200 |}}
+-02-14 New paper: Trond Saue //et al.// : //The DIRAC code for relativistic molecular calculations
+//, submitted. ([[https://arxiv.org/abs/2002.06121|arXiv]]). This paper provides a general reference to DIRAC, together with the appropriate version reference provided [[http://www.diracprogram.org/doku.php?id=citation|here]]
+-01-20 New paper: Nanna Holmgaard List, Timothé Romain Léo Melin, Martin van Horn and Trond Saue: //Beyond the electric-dipole approximation in simulations of X-ray absorption spectroscopy: Lessons from relativistic theory//, submitted. [[ https://arxiv.org/abs/2001.10738|(arXiv)]])
+-12-12 **DIRAC19** is [[http://dx.doi.org/10.5281/zenodo.3572669|here]] !!  All users are most welcome to join our [[http://groups.google.com/group/dirac-users|mailing list]].
+-10-14 New paper: Sophie Kervazo //et al.//, //Accurate Predictions of Volatile Plutonium Thermodynamic Properties//, Inorganic Chemistry 58 (2019) 14507 [[https://doi.org/10.1021/acs.inorgchem.9b02096|(electronic version)]] [[https://arxiv.org/abs/1906.03157|(arXiv)]]
+-07-15 New paper: Yongliang Hao //et al.//, // High accuracy theoretical investigations of CaF, SrF, and BaF and implications for laser-cooling//, J. Chem. Phys. 151 (2019) 034302[[https://aip.scitation.org/doi/10.1063/1.5098540|(electronic version)]]
+-05-30 New paper: Paul S. Bagus, Connie J. Nelin, C. R. Brundle and Scott A. Chambers,// A New Mechanism for XPS Line Broadening: The 2p-XPS of Ti(IV)//, The Journal of Physical Chemistry C 123, 7705 (2019) [[https://doi.org/10.1021/acs.jpcc.8b05576|(electronic version)]]
+-05-29 **New DIRAC author ! ** The citation of DIRAC makes a distinction between authors and contributors, the former being active developers over many years who also do significant community service to keep the program  in shape. This description certainly fits [[http://www.phlam.univ-lille1.fr/spip.php?article531&lang=en|André Severo Pereira Gomes]]. Congratulations !
+-05-29 The 22nd DIRAC meeting has ended. Stay tuned for the 2019 release, scheduled for the end of the year !{{ ::dirac2019photo.jpg?direct&600 |}}
+-05-26 **The 22nd DIRAC meeting has started !**
+{{ :dirac2019.jpg?direct&600 |}}
+First row: Marta Lopez Vidal, Copenhagen;  Anna Kristina Schnack-Petersen, Copenhagen; Ayaki Sunaga, Toulouse; Johann Pototschnig, Amsterdam; Alexander Efremov, Toulouse; Michal Repisky, Tromsø; Erik Hedegård, Lund; Pi Haase, Groningen; Joel Creutzberg, Lund; Eugene Gvozdetsky, Amsterdam; Radovan Bast, Tromsø; Martin van Horn, Toulouse; Stan Papadopoulos, Amsterdam; Peter Reinholdt, Odense; Erik Kjellgren, Odense; Gosia Olejniczak, Warsaw; Andre Gomes, Lille; Luuk Visscher, Amsterdam; [Trond Saue, Toulouse, taking the photo], Hans Jørgen Aa. Jensen, Odense; Maen Salman, Toulouse
 -12-28 New paper: Yassine Bouchafra, Avijit Shee, Florent Real, Valerie Vallet and Andre Severo Pereira Gomes,//Predictive Simulations of Ionization Energies of Solvated Halide Ions with Relativistic Embedded Equation of Motion Coupled Cluster Theory//, Physical Review Letters 121, 266001 (2018) [[https://doi.org/10.1103/PhysRevLett.121.266001|(electronic version)]][[https://arxiv.org/abs/1811.01902|(arXiv)]]