Thierry Leininger
Affiliations: | IRSAMC | Université Toulouse III - Paul Sabatier, Toulouse, Occitanie, France |
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Sign in to add trainee| Muammar El Khatib | grad student | 2012-2015 | Université Toulouse III - Paul Sabatier |
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Publications
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| Mattoso SH, Brumas V, Evangelisti S, et al. (2023) Electronic Structure of Pentagonal Carbon Nanocones: An ab Initio Study. The Journal of Physical Chemistry. A. 127: 9723-9732 |
| Apriliyanto YB, Faginas-Lago N, Evangelisti S, et al. (2022) Multilayer Graphtriyne Membranes for Separation and Storage of CO: Molecular Dynamics Simulations of Post-Combustion Model Mixtures. Molecules (Basel, Switzerland). 27 |
| Apriliyanto YB, Battaglia S, Evangelisti S, et al. (2021) Toward a Generalized Hückel Rule: The Electronic Structure of Carbon Nanocones. The Journal of Physical Chemistry. A. 125: 9819-9825 |
| Battaglia S, Evangelisti S, Leininger T, et al. (2020) A novel intermolecular potential to describe the interaction between the azide anion and carbon nanotubes Diamond and Related Materials. 101: 107533 |
| Battaglia S, Faginas-Lago N, Leininger T, et al. (2019) Tuning the magnetic properties of beryllium chains. Physical Chemistry Chemical Physics : Pccp |
| Escobar Azor M, Brooke L, Evangelisti S, et al. (2019) A Wigner molecule at extremely low densities: a numerically exact study Scipost Physics Core. 1 |
| Valença Ferreira de Aragão E, Moreno D, Battaglia S, et al. (2019) A simple position operator for periodic systems Physical Review B. 99 |
| Battaglia S, Bouet D, Lecoq A, et al. (2019) Distributed Gaussian orbitals for molecular calculations: application to simple systems Molecular Physics. 118: 1615646 |
| Brooke L, Diaz-Marquez A, Evangelisti S, et al. (2018) Distributed Gaussian orbitals for the description of electrons in an external potential. Journal of Molecular Modeling. 24: 216 |
| Huran AW, Ben Amor N, Evangelisti S, et al. (2018) The Electronic Structure of Beryllium Chains. The Journal of Physical Chemistry. A |