DIRAC

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===== Ph.D. dissertations and Habilitationsschriften related to DIRAC development =====

==== Ph.D. dissertations ====
{{:dissertations:fabbro_phd_thesis.pdf |Gabriele Fabbro, Université de Toulouse, F, 2025 (pdf, 2.4 MB)}}\\
Highly Accurate Molecular Properties using High-Order Relativistic Coupled Cluster Theory

{{:dissertations:thesis_xiang_yuan.pdf|Xiang Yuan, Université de Lille and Vrije Universiteit Amsterdam, F&NL, 2024 (pdf, 20.0 MB)}} \\
Molecular Properties in the Linear Response Regime and Beyond with Relativistic Coupled-Cluster

{{:dissertations:thesis_martin_van_horn.pdf|Martin van Horn, Université Toulouse III-Paul Sabatier, F, 2023 (pdf, 32.8 MB)}} \\
The Validity of the Dipole Approximation in the Simulation of X-Ray Absorption Spectroscopy

{{:dissertations:avijit_thesis.pdf|Avijit Shee, Université Toulouse III-Paul Sabatier, F, 2016 (pdf, 3.9 MB)}} \\
Relativistic Coupled Cluster Theory – in Molecular Properties and in Electronic Structure

{{:dissertations:elke_fasshauer.pdf|Elke Faßhauer, Ruprecht-Karls-Universität Heidelberg, D, 2014 (pdf, 4.3 MB)}} \\
Investigation of Relativistic Effects in Electronic Decay Processes in Small and Large Noble Gas Clusters by Ab Initio and New Simulation Approaches

{{:dissertations:13.PhD.MickaelHubert.pdf|Mickaël Hubert, UPS Toulouse, F, 2013 (pdf, 2.1 MB)}} \\
Relativistic Coupled Cluster theory for excited states at a general excitation rank. Applications to diatomic molecules

{{:dissertations:lasse_k_soerensen.pdf|Lasse Kragh Sørensen, HHU Düsseldorf, D, 2009 (pdf, 1.4 MB)}} \\
General Order Coupled-Cluster in the 4-Component Framework

{{:dissertations:stefan_knecht.pdf|Stefan Knecht, HHU Düsseldorf, D, 2009 (pdf, 2.8 MB)}} \\
Parallel Relativistic Multiconfiguration Methods: New Powerful Tools for Heavy-Element Electronic-Structure Studies

{{:dissertations:johan_henriksson.pdf|Johan Henriksson, Linköping Universitet, Linköping, S, 2008 (pdf, 2.2 MB)}} \\
Molecular Quadratic Response Properties with Inclusion of Relativity

{{:dissertations:radovan_bast.pdf|Radovan Bast, Université Louis Pasteur, Strasbourg, F, 2008 (pdf, 3.2 MB)}} \\
Quantum chemistry beyond the charge density

{{:dissertations:ulf_ekstroem.pdf|Ulf Ekström, Linköping Universitet, Linköping, S, 2007 (pdf, 24.0 MB)}} \\
Time-dependent molecular properties in the optical and x-ray regions

{{:dissertations:ivan_infante.pdf|Ivan Infante, Vrije Universiteit, Amsterdam, NL, 2006 (pdf, 4.1 MB)}} \\
Computational Studies in Actinide Chemistry

{{:dissertations:joost_van_stralen.pdf|Joost van Stralen, Vrije Universiteit, Amsterdam, NL, 2004 (pdf, 4.1 MB)}} \\
Molecular Properties in Relativistic Electronic Structure Theory

{{:dissertations:jesper_k_pedersen.pdf|Jesper K. Pedersen, University of Southern Denmark, Odense, DK, 2004 (pdf, 0.9 MB)}} \\
Description of Correlation and Relativistic Effects in Calculations of Molecular Properties

{{:dissertations:joern_thyssen.pdf|Jørn Thyssen, University of Southern Denmark, Odense, DK, 2001 (pdf, 1.7 MB)}} \\
Development and Applications of Methods for Correlated Relativistic Calculations of Molecular Properties

{{:dissertations:jon_laerdahl.pdf|Jon K. Lærdahl, University of Oslo, Oslo, N, 1997 (pdf, 0.7 MB)}} \\
Development and Application of Relativistic Quantum Chemical Methods

{{:dissertations:trond_saue.pdf|Trond Saue, University of Oslo, Oslo, N, 1996 (pdf, 3.9 MB)}} \\
Principles and Applications of Relativistic Molecular Calculations

{{:dissertations:luuk_visscher.pdf|Lucas Visscher, Rijksuniversiteit Groningen, Groningen, NL, 1993 (pdf, 0.8 MB)}} \\
Relativity and Electron Correlation in Chemistry
==== Habilitationsschriften ====

{{:dissertations:timo_fleig.pdf|Timo Fleig, HHU Düsseldorf, D, 2006 (pdf, 0.7 MB)}} \\
Wave Function Based Relativistic Multi-Reference Electron Correlation Methods. Development and Application to Atomic and Molecular Properties.

==== Habilitations à Diriger des Recherches ====

{{https://hal.archives-ouvertes.fr/tel-01960393/document|Andre Severo Pereira Gomes, Université de Lille, Fr, 2016 (pdf, 13.9 MB)}} \\
On the calculation of molecular properties of heavy element systems with ab initio approaches: from gas-phase to complex systems