Skip to Main content Skip to Navigation

Search by documents



...
tel-00735535v1  Theses
Sylvain Vidal. Mécanismes d'ionisation de systèmes libres en lumière extrême décrits par la théorie de la fonctionnelle de la densité dépendante du temps
Agrégats Moléculaires et Atomiques [physics.atm-clus]. Université Paul Sabatier - Toulouse III, 2011. Français
...
tel-01850388v1  Theses
Bastien Belzunces. Atomic-scale study of pesticide interaction with soil mineral matter.
Theoretical and/or physical chemistry. Laboratoire de Chimie et Physique Quantiques, 2017. English
...
tel-00559750v1  Theses
Jérémie Messud. Théorie de la fonctionnelle de la densité dépendant du temps avec correction d'auto-interaction.
Physique mathématique [math-ph]. Université Paul Sabatier - Toulouse III, 2009. Français
...
tel-00860445v1  Theses
Philipp Wopperer. Electron photoemission from sodium and carbon clusters
Atomic and Molecular Clusters [physics.atm-clus]. Université Paul Sabatier - Toulouse III; Universität Erlangen-Nürnberg, 2013. English
...
tel-02004348v1  Theses
Bastien Belzunces. Atomic-scale study of pesticide interaction with soil mineral matter
Inorganic chemistry. Université Paul Sabatier - Toulouse III, 2017. English. ⟨NNT : 2017TOU30352⟩
...
hal-00806033v1  Journal articles
Rémy BessonA. LegrisDamien ConnétablePhilippe Maugis. Atomic-scale study of low-temperature equilibria in iron-rich Al-C-Fe
Physical Review B: Condensed Matter and Materials Physics (1998-2015), American Physical Society, 2008, vol. 78, pp.014204/1-014204/11. ⟨10.1103/PhysRevB.78.014204⟩
...
tel-01273039v1  Theses
Vijay Gopal Chilkuri. Study of double exchange phenomenon: from microscopic origins to collective properties
Chemical Physics [physics.chem-ph]. Universite Toulouse III Paul Sabatier, 2015. English
hal-00760952v1  Journal articles
Stefan KnechtSamuel FuxRobert van MeerLucas VisscherMarkus Reiher et al.  Mössbauer spectroscopy for heavy elements: a relativistic benchmark study of mercury
Theoretical Chemistry Accounts: Theory, Computation, and Modeling, Springer Verlag, 2011, 129, pp.631. ⟨10.1007/s00214-011-0911-2⟩
...
tel-01599830v1  Theses
Lionel Lacombe. On dynamics beyond time-dependent mean-field theories
Condensed Matter [cond-mat]. Université Paul Sabatier - Toulouse III, 2016. English. ⟨NNT : 2016TOU30185⟩
...
hal-02814121v1  Journal articles
Francesco AquilanteJochen AutschbachAlberto BaiardiStefano BattagliaVeniamin Borin et al.  Modern quantum chemistry with [Open]Molcas
Journal of Chemical Physics, American Institute of Physics, 2020, 152 (21), pp.214117. ⟨10.1063/5.0004835⟩
hal-02042483v1  Book sections
Emmanuel GrasS. Chassaing. Carbenes and Nitrenes
Knipe, A. C. Organic Reaction Mechanisms-2012: An annual survey covering the literature dated january to december 2012, 4, John Wiley & Sons, pp.171-208, 2015, 978-1-118-36259-4
hal-02042484v1  Book sections
Emmanuel GrasS. Chassaing. Carbenes and Nitrenes
Knipe, A. C. Organic Reaction Mechanisms-2013: An annual survey covering the literature dated january to december 2013, 4, John Wiley & Sons, pp.177-215, 2016, 978-1-118-70786-9
hal-00947100v1  Journal articles
Joan VignolleX. CattoenD. Bourissou. Stable Noncyclic Singlet Carbenes
Chemical Reviews, American Chemical Society, 2009, 109 (8), pp.3333-3384. ⟨10.1021/cr800549j⟩
hal-01495767v1  Journal articles
R. RodriguezY. ContieR. NouguéA. BaceiredoN. Saffon-Merceron et al.  Reversible Silylene Insertion Reactions into Si−H and P−H σ-Bonds at Room Temperature
Angewandte Chemie International Edition, Wiley-VCH Verlag, 2016, 55 (46), pp.14355--14358. ⟨10.1002/anie.201606728⟩