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Journal Article
The Journal of Chemical Physics, ISSN 0021-9606, 05/2018, Volume 148, Issue 17, p. 174303
The smallest doubly charged coronene cluster ions reported so far, Cor152+, were produced by charge exchange between bare coronene clusters and He2+ [H. A. B.... 
ELECTRON-IMPACT | MOLECULAR CLUSTERS | CORANNULENE | BENZENE CLUSTERS | POLYCYCLIC AROMATIC-HYDROCARBONS | STABILITY | PHYSICS, ATOMIC, MOLECULAR & CHEMICAL | CHEMISTRY, PHYSICAL | IONS | FISSION | COULOMB EXPLOSION | DOUBLE-IONIZATION
Journal Article
Physical Chemistry Chemical Physics, ISSN 1463-9076, 2016, Volume 18, Issue 31, pp. 21412 - 21420
Journal Article
European Journal of Inorganic Chemistry, ISSN 1434-1948, 10/2017, Volume 2017, Issue 38-39, pp. 4546 - 4551
Systematic experimental and theoretical studies have shown that anionic boron clusters (Bn–) possess planar or quasi‐planar (2D) structures in a wide range of... 
Boron | Density functional calculations | Chemical bonding | Borophenes | Photoelectron spectroscopy | Cluster compounds | Density functionals | Polycyclic aromatic hydrocarbons | Specific gravity | Analysis | Vacancies | Landscape | Structural stability | Triangles | Clusters | Chemical bonds | Borophene | Density functional theory | Isomers | Defects
Journal Article
Chemical Science, ISSN 2041-6520, 2018, Volume 9, Issue 8, pp. 2301 - 2318
The interaction of polycyclic aromatic hydrocarbon molecules with water (H2O = W) is of fundamental importance in chemistry and biology. Herein, size-selected... 
Protons | Solvents | Chemical analysis | Hydration | Quantum chemistry | Bifurcations | Photodissociation | Isomers | Solvation | Naphthalene | Hydrogen bonds | Polycyclic aromatic hydrocarbons | Benzene | Bonding strength | Clusters | Chemical bonds | Evolution | Affinity | Density functional theory | Cations
Journal Article
Proceedings of the Combustion Institute, ISSN 1540-7489, 2015, Volume 35, Issue 2, pp. 1811 - 1818
Journal Article
Journal of Chemical Physics, ISSN 0021-9606, 2014, Volume 140, Issue 3, p. 34301
We propose in the present paper a SCC-DFTB/FF (Self-Consistent-Charge Density Functional based Tight Binding/Force-Field) scheme adapted to the investigation... 
Binding | Charge density | Polycyclic aromatic hydrocarbons | Benzene | Hydrocarbons | Ionization potentials | Mathematical models | Clustering | Rare gases
Journal Article