Browsing by Author Bromley, Stefan Thomas
Showing results 24 to 43 of 50
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Issue Date | Title | Author(s) |
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21-Apr-2021 | Formation of Interstellar Silicate Dust via Nanocluster Aggregation: Insights From Quantum Chemistry Simulations | Rimola, Albert; Bromley, Stefan Thomas |
15-Feb-2017 | Global optimisation of hydroxylated silica clusters: a cascade Monte Carlo Basin Hopping approach | Cuko, Andi; Macià Escatllar, Antoni; Calatayud, Mònica; Bromley, Stefan Thomas |
7-Dec-2022 | How graphenic are graphynes? Evidence for low-lying correlated gapped states in graphynes | Lleopart, Genís; Lopez Suarez, Miquel; De P.R. Moreira, Ibério; Bromley, Stefan Thomas |
2006 | Importance of the embedding environment on the strain within small rings in siliceous materials | Bromley, Stefan Thomas; Moreira, Ibério de Pinho Ribeiro; Illas i Riera, Francesc; Wojdel, Jacek C. |
1-May-2015 | Kondo Effect in a Neutral and Stable All Organic Radical Single Molecule Break Junction | Frisenda, Riccardo; Gaudenzi, Rocco; Franco, Carlos; Mas Torrent, Marta; Rovira i Angulo, Concepció; Veciana, Jaume; Alcón Rovira, Isaac; Bromley, Stefan Thomas; Burzurí, Enrique; van der Zant, Herre S. J. |
24-Sep-2018 | Modelling Nano-Oxide Materials with Technological and Environmental Relevance: Silica, Titania and Titanosilicates | Cuko, Andi |
13-Jun-2013 | Nanofilm versus Bulk Polymorphism in Wurtzite Materials | Demiroglu, Ilker; Bromley, Stefan Thomas |
10-May-2017 | Nucleation of small silicon carbide dust clusters in AGB stars | Gobrecht, David; Cristallo, Sergio; Piersanti, Luciano; Bromley, Stefan Thomas |
18-Jan-2017 | Operative mechanism of hole-assisted negative charge motion in ground states of radical-anion molecular wires | Franco, Carlos; Mayorga Burrezo, Paula; Lloveras, Vega; Caballero, Ruben; Alcón Rovira, Isaac; Bromley, Stefan Thomas; Mas Torrent, Marta; Langa, Fernando; López Navarrete, Juan T.; Rovira i Angulo, Concepció; Casado, Juan; Veciana, Jaume |
3-Jul-2008 | Optical excitations of defects in realistic nanoscale silica clusters: comparing the performance of density functional theory using hybrid functionals with correlated wavefunction methods | Zwijnenburg, M. A.; Sousa Romero, Carmen; Sokol, A. A.; Bromley, Stefan Thomas |
21-Jan-2017 | Predicting size-dependent emergence of crystallinity in nanomaterials: titania nanoclusters versus nanocrystals | Lamiel Garcia, Josep Oriol; Cuko, Andi; Calatayud, Mònica; Illas i Riera, Francesc; Bromley, Stefan Thomas |
21-Jul-2010 | Prospective role of multicenter bonding for efficient and selective hydrogen transport | Stradi, Daniele; Illas i Riera, Francesc; Bromley, Stefan Thomas |
14-Mar-2018 | Rational chemical design of Triarylmethyl-based devices and 2D materials | Alcón Rovira, Isaac |
2-Feb-2015 | Reduced ceria nanofilms from structure prediction | Kozlov, Sergey; Demiroglu, Ilker; Neyman, Konstantin M.; Bromley, Stefan Thomas |
3-Apr-2019 | Room temperature methane capture and activation by Ni clusters supported on TiC(001): effects of metal-carbide interactions on the cleavage of the C-H bond | Prats Garcia, Hèctor; Gutiérrez, Ramón A.; Piñero, Juan José; Viñes Solana, Francesc; Bromley, Stefan Thomas; Ramírez, Pedro J.; Rodríguez, José A.; Illas i Riera, Francesc |
28-Jul-2017 | Size dependent structural and polymorphic transitions in ZnO: from nanocluster to bulk | Viñes Solana, Francesc; Lamiel Garcia, Josep Oriol; Illas i Riera, Francesc; Bromley, Stefan Thomas |
5-Nov-2015 | Structural control over spin localization in triarylmethyls | Alcón Rovira, Isaac; Bromley, Stefan Thomas |
17-Sep-2009 | The effect of local environment on photoluminescence: a TD-DFT study of silanone groups on the surface of silica nanostructures | Zwijnenburg, M. A.; Sokol, A. A.; Sousa Romero, Carmen; Bromley, Stefan Thomas |
11-Feb-2011 | The fate of optical excitations in small polyhedral ZnS clusters: a theoretical study of the excitation and localization of electrons in Zn4S4 and Zn6S6 | Zwijnenburg, M. A.; Sousa Romero, Carmen; Illas i Riera, Francesc; Bromley, Stefan Thomas |
12-Apr-2016 | Tuning Crystal Ordering, Electronic Structure, and Morphology in Organic Semiconductors: Tetrathiafulvalenes as a Model Case | Pfattner, Raphael; Bromley, Stefan Thomas; Rovira i Angulo, Concepció; Mas Torrent, Marta |