Bromley ST - Search Results

1

Tuning electronic levels in photoactive hydroxylated titania nanosystems: combining the ligand dipole effect and quantum confinement.

Recio-Poo M, Morales-García Á, Illas F, Bromley ST. Recio-Poo M, et al. Among authors: bromley st. Nanoscale. 2024 May 9;16(18):8975-8985. doi: 10.1039/d3nr06189b. Nanoscale. 2024. PMID: 38618709

2

Minimum conditions for accurate modeling of urea production via co-electrolysis.

Urrego-Ortiz R, Builes S, Illas F, Bromley ST, Figueiredo MC, Calle-Vallejo F. Urrego-Ortiz R, et al. Among authors: bromley st. Commun Chem. 2023 Sep 13;6(1):196. doi: 10.1038/s42004-023-00990-7. Commun Chem. 2023. PMID: 37704802 Free PMC article.

3

Computational astrochemistry: general discussion.

Bromley ST, Brünken S, Ceccarelli C, Cordiner M, Darnell K, Dufour G, Flint A, Garrod RT, Gudipati MS, Halpern J, Herbst E, Huang KY, Kamp I, Madhusudhan N, McCoustra MRS, Suits AG, Van de Sande M, van Dishoeck EF, Viti S, Wiesenfeld L. Bromley ST, et al. Faraday Discuss. 2023 Sep 20;245(0):620-637. doi: 10.1039/d3fd90027d. Faraday Discuss. 2023. PMID: 37667846 No abstract available.

4

Predicting observable infrared signatures of nanosilicates in the diffuse interstellar medium.

Zeegers ST, Guiu JM, Kemper F, Marshall JP, Bromley ST. Zeegers ST, et al. Among authors: bromley st. Faraday Discuss. 2023 Sep 20;245(0):609-619. doi: 10.1039/d3fd00055a. Faraday Discuss. 2023. PMID: 37335292

5

A machine learning potential for simulating infrared spectra of nanosilicate clusters.

Tang Z, Bromley ST, Hammer B. Tang Z, et al. Among authors: bromley st. J Chem Phys. 2023 Jun 14;158(22):224108. doi: 10.1063/5.0150379. J Chem Phys. 2023. PMID: 37290080

6

Buckletronics: how compression-induced buckling affects the mechanical and electronic properties of sp²-based two-dimensional materials.

Lopez-Suarez M, Lleopart G, Morales-Salvador R, Moreira IPR, Bromley ST. Lopez-Suarez M, et al. Among authors: bromley st. Philos Trans A Math Phys Eng Sci. 2023 Jul 10;381(2250):20220248. doi: 10.1098/rsta.2022.0248. Epub 2023 May 22. Philos Trans A Math Phys Eng Sci. 2023. PMID: 37211030

7

Emergent Spin Frustration in Neutral Mixed-Valence 2D Conjugated Polymers: A Potential Quantum Materials Platform.

Alcón I, Ribas-Ariño J, Moreira IPR, Bromley ST. Alcón I, et al. Among authors: bromley st. J Am Chem Soc. 2023 Mar 15;145(10):5674-5683. doi: 10.1021/jacs.2c11185. Epub 2023 Mar 6. J Am Chem Soc. 2023. PMID: 36877195 Free PMC article.

8

Crystal properties without crystallinity? Influence of surface hydroxylation on the structure and properties of small TiO₂ nanoparticles.

Recio-Poo M, Morales-García Á, Illas F, Bromley ST. Recio-Poo M, et al. Among authors: bromley st. Nanoscale. 2023 Mar 9;15(10):4809-4820. doi: 10.1039/d3nr00141e. Nanoscale. 2023. PMID: 36786054

9

Stable Organic Radical for Enhancing Metal-Monolayer-Semiconductor Junction Performance.

De Sousa JA, Pfattner R, Gutiérrez D, Jutglar K, Bromley ST, Veciana J, Rovira C, Mas-Torrent M, Fabre B, Crivillers N. De Sousa JA, et al. Among authors: bromley st. ACS Appl Mater Interfaces. 2023 Jan 25;15(3):4635-4642. doi: 10.1021/acsami.2c15690. Epub 2023 Jan 15. ACS Appl Mater Interfaces. 2023. PMID: 36642951 Free PMC article.

10

How graphenic are graphynes? Evidence for low-lying correlated gapped states in graphynes.

Lleopart G, Lopez-Suarez M, de P R Moreira I, Bromley ST. Lleopart G, et al. Among authors: bromley st. J Chem Phys. 2022 Dec 7;157(21):214704. doi: 10.1063/5.0125637. J Chem Phys. 2022. PMID: 36511546

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