Ángel Morales‐García - Publications, H-index & Citations

Ángel Morales‐García

universitat de barcelona

30H指数

113论文数

3.9K被引数

收录论文 70

发表时间

Enhancing Selectivity of AuCu Electrocatalysts for CO₂ Electroreduction in Chloride Electrolyte 在氯化物电解质中增强AuCu电催化剂对CO₂电还原的选择性

ChemCatChem

IF3.9

2026-09-10

OAAI

Mohamed Amazian; Daniel Dolz; Bokinala Moses Abraham; Maria Sarret; Ángel Morales-García; Francesc Viñes; Francesc Illas; Teresa Andreu

YTaNO2 Janus MXene as an optimal electrocatalyst for the hydrogen evolution reaction 钇钽氮氧 Janus MXene 作为最优析氢反应电催化剂

phys. chem. chem. phys.

IF0

2026-04-17

PREAI

Latifa Bettadj; Reda M. Boufatah; Tarik Ouahrani; Chewki Ougherb; Ángel Morales-García; Michael Badawi; Daniel Errandonea

Structural and electronic properties of MXene flakes: from edge effects to bandgap evolution MXene片层的结构及电子性质：从边缘效应到能带演化的研究

Nanoscale

IF5.1

2026-03-11

OAAI

Miquel Allés; Sergi Vela; Ángel Morales-García; Francesc Viñes; Carmen Sousa

Computational Modeling of Catalysis by MXenes: Key Aspects MXenes催化作用的计算建模：关键方面

Accounts of Materials Research

IF14.7

2026-02-23

OAAI

Ángel Morales-García; Francesc Viñes; Francesc Illas

Accurate Prediction of Adsorption and Diffusion Energies of Single Metal Atoms Supported on MXenes from Machine Learning 基于机器学习的MXenes负载单金属原子吸附与扩散能的精确预测

npj 2D Materials and Applications

IF8.8

2025-12-11

OAAI

Daniel Dolz; Sara Pibernat; Ángel Morales-García; Francesc Viñes; Francesc Illas

Revealing Recombination and Ultrafast Relaxation Mechanisms in Atomically Precise Titania Nanoclusters 揭示原子级精确二氧化钛纳米簇中的重组和超快弛豫机制

Journal of the American Chemical Society

IF15.6

2025-10-24

PREAI

Miguel Recio-Poo; Chase H. Rotteger; Francesc Illas; Stefan T. Bromley; Ángel Morales-García; Scott G. Sayres; Alexey V. Akimov

Cutting edge(s): towards realistic modelling of MXene flakes 尖端技术：MXene片材的现实建模方法

Nanoscale

IF5.1

2025-09-26

OAAI

Néstor García-Romeral; Ángel Morales-García; Francesc Viñes; Francesc Illas

Surface engineering and electronegativity effects on the catalytic performance of Hf 2CO 2 MXene: An ab initio study 表面工程和电负性效应对Hf₂CO₂ MXene催化性能的影响：一项基于第一性原理的研究

Journal of Physics and Chemistry of Solids

IF4.9

2025-09-08

PREAI

Souhila Khobzaoui; Tarik Ouahrani; Ángel Morales-García; Daniel Errandonea

First-principles study of the electrocatalytic behavior of Hf 4C 3 MXene 第一性原理研究Hf4C3 MXene的电催化行为

Journal of Physics and Chemistry of Solids

IF4.9

2025-08-09

PREAI

Ouarda Azzi; Tarik Ouahrani; Chewki Ougherb; David Dell’Angelo; Ángel Morales-García; Michael Badawi

Impact of Surface Hydroxylation on the Structural and Electronic Properties of 2-3.5 nm Diameter Crystalline and Amorphous Titania Nanoparticles

JOURNAL OF PHYSICAL CHEMISTRY C

IF3.2

2025-02-04

PREAI

Recio-Poo, Miguel; Morales-Garcia, Angel; Bromley, Stefan T.

Hydration Accelerates Radiative and Nonradiative Recombination in Small TiO2 Nanoclusters

JOURNAL OF PHYSICAL CHEMISTRY C

IF3.2

2025-01-10

PREAI

Recio-Poo, Miguel; Shakiba, Mohammad; Illas, Francesc; Bromley, Stefan T.; Akimov, Alexey V.; Morales-Garcia, Angel

Effect of the Ti2CT x (T x = O, OH, and H) Functionalization on the Formation of (TiO2)5/Ti2CT x Composites

JOURNAL OF PHYSICAL CHEMISTRY C

IF3.2

2024-12-19

OAAI

Garcia-Romeral, Nestor; Morales-Garcia, Angel; Vines, Francesc

Density Functional Theory (DFT) and Time-Dependent DFT (TDDFT) Studies of Porphyrin Adsorption on Graphene: Insights on the Effect of Substituents and Central Metal on Adsorption Energies 卟啉在石墨烯上吸附的密度泛函理论 (DFT) 和时间依赖性DFT (TDDFT) 研究: 关于取代基和中心金属对吸附能的影响的见解

JOURNAL OF COMPUTATIONAL CHEMISTRY

IF4.8

2024-12-05

PREAI

Gara, Rayene; Morales-Garcia, Angel; Arfaoui, Youssef; Illas, Francesc

Janus ScYCBr2 MXene as a Promising Thermoelectric Material Janus ScYCBr2 MXene作为一种有前途的热电材料

ACS APPLIED ENERGY MATERIALS

IF5.5

2024-07-22

OAAI

Ould-Mohamed, Mounir; Ouahrani, Tarik; Boufatah, Reda; Morales-Garcia, Angel; Franco, Ruth; Badawi, Michael; Errandonea, Daniel

Understanding the Reverse Water Gas Shift Reaction over Mo2C MXene Catalyst: A Holistic Computational Analysis

CHEMCATCHEM

IF3.9

2024-03-12

OAAI

Dolz, Daniel; De Armas, Raul; Lozano-Reis, Pablo; Morales-Garcia, Angel; Vines, Francesc; Sayos, Ramon; Illas, Francesc

Understanding the Chemical Bond in Semiconductor/MXene Composites: TiO2 Clusters Anchored on the Ti2C MXene Surface

CHEMISTRY-A EUROPEAN JOURNAL

IF3.7

2024-02-13

OAAI

Garcia-Romeral, Nestor; Keyhanian, Masoomeh; Morales-Garcia, Angel; Vines, Francesc; Illas, Francesc

Estimating Nonradiative Excited-State Lifetimes in Photoactive Semiconducting Nanostructures

JOURNAL OF PHYSICAL CHEMISTRY C

IF3.2

2024-02-01

OAAI

Valero, Rosendo; Morales-Garcia, Angel; Illas, Francesc

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

NANOSCALE

IF5.1

2024-01-01

OAAI

Recio-Poo, Miguel; Morales-Garcia, Angel; Illas, Francesc; Bromley, Stefan T.

Role of N Doping in the Reduction of Titania Nanostructures

JOURNAL OF PHYSICAL CHEMISTRY C

IF3.2

2023-10-02

OAAI

Remesal, Elena; Morales-Garcia, Angel; Illas, Francesc

Effect of intrinsic point defects on the catalytic and electronic properties of Cu2WS4 single layer: Ab initio calculations

PHYSICAL REVIEW MATERIALS

IF3.4

2023-02-17

OAAI

Ouahrani, Tarik; Boufatah, Reda M.; Benaissa, Mohammed; Morales-Garcia, Angel; Badawi, Michael; Errandonea, Daniel

研究方向