Stefan T Bromley

ResearcherID ORCID

Publication Activity (10 Years)

Years Active: 2016-2024
Publications (10 Years): 40

Top Topics

Density Functional Theory

Oxide Nanoparticles

Atomic Force Microscopy

Room Temperature

Top Venues

The journal of physical chemistry letters

Journal of the American Chemical Society

ACS applied materials & interfaces

This page only lists publications with an associated author ORCID identifier.

Publications

Miguel Recio-Poo, Ángel Morales-García, Francesc Illas, Stefan T Bromley
Size-Dependent Ab Initio Atomistic Thermodynamics from Cluster to Bulk: Application to Hydration of Titania Nanoparticles. The journal of physical chemistry letters 15 (32) (2024)
Miguel Recio-Poo, Ángel Morales-García, Francesc Illas, Stefan T Bromley
Size-Dependent Ab Initio Atomistic Thermodynamics from Cluster to Bulk: Application to Hydration of Titania Nanoparticles. The journal of physical chemistry letters (2024)
Miguel Recio-Poo, Ángel Morales-García, Francesc Illas, Stefan T Bromley
Tuning electronic levels in photoactive hydroxylated titania nanosystems: combining the ligand dipole effect and quantum confinement. Nanoscale (2024)
Andreu A de Donato, Bianca-Andreea Ghejan, Joost M Bakker, Thorsten M Bernhardt, Stefan T Bromley, Sandra M Lang
Gas-Phase Production of Hydroxylated Silicon Oxide Cluster Cations: Structure, Infrared Spectroscopy, and Astronomical Relevance. ACS earth & space chemistry 8 (6) (2024)
Miguel Recio-Poo, Ángel Morales-García, Francesc Illas, Stefan T Bromley
Size-Dependent Ab Initio Atomistic Thermodynamics from Cluster to Bulk: Application to Hydration of Titania Nanoparticles. The journal of physical chemistry letters 15 (32) (2024)
Miguel Recio-Poo, Ángel Morales-García, Francesc Illas, Stefan T Bromley
Tuning electronic levels in photoactive hydroxylated titania nanosystems: combining the ligand dipole effect and quantum confinement. Nanoscale 16 (18) (2024)
Miguel Recio-Poo, Ángel Morales-García, Francesc Illas, Stefan T Bromley
Size-Dependent Ab Initio Atomistic Thermodynamics from Cluster to Bulk: Application to Hydration of Titania Nanoparticles. The journal of physical chemistry letters 15 (32) (2024)
Andreu A de Donato, Bianca-Andreea Ghejan, Joost M Bakker, Thorsten M Bernhardt, Stefan T Bromley, Sandra M Lang
Gas-Phase Production of Hydroxylated Silicon Oxide Cluster Cations: Structure, Infrared Spectroscopy, and Astronomical Relevance. ACS earth & space chemistry 8 (6) (2024)
Isaac Alcón, Jordi Ribas-Ariño, Iberio de P R Moreira, Stefan T Bromley
Emergent Spin Frustration in Neutral Mixed-Valence 2D Conjugated Polymers: A Potential Quantum Materials Platform. Journal of the American Chemical Society 145 (10) (2023)
Sascha T Zeegers, Joan Mariñoso Guiu, Francisca Kemper, Jonathan P Marshall, Stefan T Bromley
Predicting observable infrared signatures of nanosilicates in the diffuse interstellar medium. Faraday discussions (2023)
Isaac Alcón, Jordi Ribas-Ariño, Iberio de P R Moreira, Stefan T Bromley
Emergent Spin Frustration in Neutral Mixed-Valence 2D Conjugated Polymers: A Potential Quantum Materials Platform. Journal of the American Chemical Society 145 (10) (2023)
Isaac Alcón, Jordi Ribas-Ariño, Iberio de P R Moreira, Stefan T Bromley
Emergent Spin Frustration in Neutral Mixed-Valence 2D Conjugated Polymers: A Potential Quantum Materials Platform. Journal of the American Chemical Society (2023)
Isaac Alcón, Jordi Ribas-Ariño, Iberio de P R Moreira, Stefan T Bromley
Emergent Spin Frustration in Neutral Mixed-Valence 2D Conjugated Polymers: A Potential Quantum Materials Platform. Journal of the American Chemical Society 145 (10) (2023)
Miguel Recio-Poo, Ángel Morales-García, Francesc Illas, Stefan T Bromley
Crystal properties without crystallinity? Influence of surface hydroxylation on the structure and properties of small TiO 2 nanoparticles. Nanoscale 15 (10) (2023)
J Alejandro de Sousa, Raphael Pfattner, Diego Gutiérrez, Kilian Jutglar, Stefan T Bromley, Jaume Veciana, Concepció Rovira, Marta Mas-Torrent, Bruno Fabre, Núria Crivillers
Stable Organic Radical for Enhancing Metal-Monolayer-Semiconductor Junction Performance. ACS applied materials & interfaces 15 (3) (2023)
Miguel Recio-Poo, Ángel Morales-García, Francesc Illas, Stefan T Bromley
Crystal properties without crystallinity? Influence of surface hydroxylation on the structure and properties of small TiO 2 nanoparticles. Nanoscale (2023)
Isaac Alcón, Jordi Ribas-Ariño, Iberio de P R Moreira, Stefan T Bromley
Emergent Spin Frustration in Neutral Mixed-Valence 2D Conjugated Polymers: A Potential Quantum Materials Platform. Journal of the American Chemical Society 145 (10) (2023)
Miquel Lopez-Suarez, Genis Lleopart, Raul Morales-Salvador, Ibério de P R Moreira, Stefan T Bromley
Buckletronics: how compression-induced buckling affects the mechanical and electronic properties of sp 2 -based two-dimensional materials. Philosophical transactions. Series A, Mathematical, physical, and engineering sciences 381 (2250) (2023)
J Alejandro de Sousa, Raphael Pfattner, Diego Gutiérrez, Kilian Jutglar, Stefan T Bromley, Jaume Veciana, Concepció Rovira, Marta Mas-Torrent, Bruno Fabre, Núria Crivillers
Stable Organic Radical for Enhancing Metal-Monolayer-Semiconductor Junction Performance. ACS applied materials & interfaces 15 (3) (2023)
J Alejandro de Sousa, Raphael Pfattner, Diego Gutiérrez, Kilian Jutglar, Stefan T Bromley, Jaume Veciana, Concepció Rovira, Marta Mas-Torrent, Bruno Fabre, Núria Crivillers
Stable Organic Radical for Enhancing Metal-Monolayer-Semiconductor Junction Performance. ACS applied materials & interfaces 15 (3) (2023)
J Alejandro de Sousa, Raphael Pfattner, Diego Gutiérrez, Kilian Jutglar, Stefan T Bromley, Jaume Veciana, Concepció Rovira, Marta Mas-Torrent, Bruno Fabre, Núria Crivillers
Stable Organic Radical for Enhancing Metal-Monolayer-Semiconductor Junction Performance. ACS applied materials & interfaces (2023)
Zeyuan Tang, Stefan T Bromley, Bjørk Hammer
A machine learning potential for simulating infrared spectra of nanosilicate clusters. The Journal of chemical physics 158 (22) (2023)
Miguel Recio-Poo, Ángel Morales-García, Francesc Illas, Stefan T Bromley
Crystal properties without crystallinity? Influence of surface hydroxylation on the structure and properties of small TiO 2 nanoparticles. Nanoscale 15 (10) (2023)
Joan Mariñoso Guiu, Bianca-Andreea Ghejan, Thorsten M Bernhardt, Joost M Bakker, Sandra M Lang, Stefan T Bromley
Cluster Beam Study of (MgSiO 3 ) + -Based Monomeric Silicate Species and Their Interaction with Oxygen: Implications for Interstellar Astrochemistry. ACS earth & space chemistry 6 (10) (2022)
Giovanni Di Liberto, Ángel Morales-García, Stefan T Bromley
An unconstrained approach to systematic structural and energetic screening of materials interfaces. Nature communications 13 (1) (2022)
Joan Mariñoso Guiu, Stefan T Bromley
Efficiency of Interstellar Nanodust Heating: Accurate Bottom-up Calculations of Nanosilicate Specific Heat Capacities. The journal of physical chemistry. A 126 (24) (2022)
Genís Lleopart, Miquel Lopez-Suarez, Iberio de P R Moreira, Stefan T Bromley
How graphenic are graphynes? Evidence for low-lying correlated gapped states in graphynes. The Journal of chemical physics 157 (21) (2022)
Juan José Piñero, Boutheïna Kerkeni, Francesc Viñes, Stefan T Bromley
Can calculated harmonic vibrational spectra rationalize the structure of TiC-based nanoparticles? Physical chemistry chemical physics : PCCP 24 (2) (2022)
Isaac Alcón, Raúl Santiago, Jordi Ribas-Arino, Mercè Deumal, Ibério de P R Moreira, Stefan T Bromley
Controlling pairing of π-conjugated electrons in 2D covalent organic radical frameworks via in-plane strain. Nature communications 12 (1) (2021)
M R Ajayakumar, César Moreno, Isaac Alcón, Francesc Illas, Concepció Rovira, Jaume Veciana, Stefan T Bromley, Aitor Mugarza, Marta Mas-Torrent
Neutral Organic Radical Formation by Chemisorption on Metal Surfaces. The journal of physical chemistry letters 11 (10) (2020)
Boutheïna Kerkeni, Marie-Christine Bacchus-Montabonel, Xiao Shan, Stefan T Bromley
Understanding H2 Formation on Hydroxylated Pyroxene Nanoclusters: Ab Initio Study of the Reaction Energetics and Kinetics. The journal of physical chemistry. A 123 (43) (2019)
Hèctor Prats, Ramón A Gutiérrez, Juan José Piñero, Francesc Viñes, Stefan T Bromley, Pedro J Ramírez, José A Rodríguez, Francesc Illas
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. Journal of the American Chemical Society 141 (13) (2019)
Hector Prats, Juan José Piñero, Francesc Viñes, Stefan T Bromley, Ramon Sayós, Francesc Illas
Assessing the usefulness of transition metal carbides for hydrogenation reactions. Chemical communications (Cambridge, England) 55 (85) (2019)
Stefan T Bromley, Juan Carlos Gómez Martín, John M C Plane
Under what conditions does (SiO)N nucleation occur? A bottom-up kinetic modelling evaluation. Physical chemistry chemical physics : PCCP 18 (38) (2018)
Oriol Lamiel-Garcia, Andi Cuko, Monica Calatayud, Francesc Illas, Stefan T Bromley
Predicting size-dependent emergence of crystallinity in nanomaterials: titania nanoclusters versus nanocrystals. Nanoscale 9 (3) (2018)
Antoni Macià Escatllar, Piero Ugliengo, Stefan T Bromley
Modeling hydroxylated nanosilica: Testing the performance of ReaxFF and FFSiOH force fields. The Journal of chemical physics 146 (22) (2018)
Kyoung Chul Ko, Stefan T Bromley, Jin Yong Lee, Francesc Illas
Size-Dependent Level Alignment between Rutile and Anatase TiO2 Nanoparticles: Implications for Photocatalysis. The journal of physical chemistry letters 8 (22) (2017)
Daeheum Cho, Kyoung Chul Ko, Oriol Lamiel-García, Stefan T Bromley, Jin Yong Lee, Francesc Illas
Correction to Effect of Size and Structure on the Ground-State and Excited-State Electronic Structure of TiO2 Nanoparticles. Journal of chemical theory and computation 13 (11) (2017)
Isaac Alcón, Francesc Viñes, Iberio de P R Moreira, Stefan T Bromley
Existence of multi-radical and closed-shell semiconducting states in post-graphene organic Dirac materials. Nature communications 8 (1) (2017)
Isaac Alcón, Daniel Reta, Iberio de P R Moreira, Stefan T Bromley
Design of multi-functional 2D open-shell organic networks with mechanically controllable properties. Chemical science 8 (2) (2016)