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M

Mercedes Alonso

vrije universiteit brussel

31H指数
209论文数
4.1K被引数
收录论文 67
发表时间
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Quantum Interference and Aromaticity Control in Triazine-Based Molecular Junctions: A Combined Green's Function and Density Functional Theory Study量子干涉与芳香性调控在基于三嗪的分子结中：格林函数与密度泛函理论的联合研究
errJournal of Computational Chemistry
IF4.8
err2026-04-12
err0
PREAI
errSergio Moles Quintero; Artur Brotons-Rufes; Irene Casademont-Reig; Albert Poater; Miquel Solà; Sergio Posada-Pérez; Mercedes Alonso
err分享
err收藏
From local to global or semilocal aromaticity: singlet–triplet switching in porphyrin tapes从局部到全局或半局部芳香性：卟啉带中的单线态-三线态转换
errchem. commun.
IF0
err2026-03-12
err0
PREAI
errSergio Moles Quintero; Luis Álvarez-Thon; William Tiznado; Luis Leyva-Parra; Mercedes Alonso
err分享
err收藏
Energy and Real Space Characteristics of Non-Covalent Interactions Across the Periodic Table非共价相互作用在整个周期表中的能量和实空间特性
errJOURNAL OF COMPUTATIONAL CHEMISTRY
IF4.8
err2025-12-05
err0
errOAAI
errDesmedt, Eline; Zator, Katarzyna; Woller, Tatiana; Boto, Roberto A.; Alonso, Mercedes; Contreras-garcia, Julia
err分享
err收藏
Ruthenium-Catalyzed Azide-Selenoalkyne Cycloadditions: A Combined Synthetic–Computational Study into Reaction Scope, Mechanism, and Origins of Regioselectivity钌催化的叠氮-硒代炔环加成反应：一项结合合成-计算研究的反应范围、机制及区域选择性的起源研究
errAdvanced Synthesis & Catalysis
IF4
err2025-10-09
err0
errOAAI
errFrances E. Bugden; Andrew D. Bage; Ashima Bajaj; Bin Wang; Fiona J. Gibson; Henry Stone; Yingjian Xu; Frank De Proft; Mercedes Alonso; Mark D. Greenhalgh
err分享
err收藏
Multidimensional analysis and visualization of aromaticity in five- and six-membered ring compounds五元环和六元环化合物中芳香性的多维分析与可视化
errneural computing applications
IF0
err2025-09-20
err0
PREAI
errMercedes Alonso; Vitor M. R. Cunha; Alexandra Galhano; António M. Lopes; J. A. Tenreiro Machado
err分享
err收藏
Exploring Aromaticity in Expanded Porphyrins: A Multidimensional Approach to Structure–Property Relationships探索扩展卟啉中的芳香性：结构与性质关系的多维方法
errchemistrymethods
IF0
err2025-09-18
err0
errOAAI
errFreija De Vleeschouwer; Eline Desmedt; Mercedes Alonso
err分享
err收藏
Pursuit of singlet fission fulvene candidates using inverse design基于逆向设计的单线态裂分呋喃类化合物候选物的筛选
errDigital Discovery
IF5.6
err2025-07-26
err0
errOAAI
errIrene Casademont-Reig; Roger Monreal-Corona; Eline Desmedt; Freija De Vleeschouwer; Mercedes Alonso
err分享
err收藏
Bond Lengths and Dipole Moments of Diatomic Molecules under Isotropic Pressure with the XP-PCM and GOSTSHYP Models
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2024-08-27
err3
PREAI
errEeckhoudt, Jochen; Alonso, Mercedes; Geerlings, Paul; De Proft, Frank
err分享
err收藏
Aromaticity in the Spectroscopic Spotlight of Hexaphyrins
errCHEMISTRY-A EUROPEAN JOURNAL
IF3.7
err2024-08-12
err2
PREAI
errDesmedt, Eline; Casademont-Reig, Irene; Monreal-Corona, Roger; De Vleeschouwer, Freija; Alonso, Mercedes
err分享
err收藏
Similarities and Differences in Benzene Reduction with Ca, Sr, Yb and Sm: Strong Evidence for Tetra-Anionic Benzene
errANGEWANDTE CHEMIE-INTERNATIONAL EDITION
IF16.9
err2024-05-14
err8
errOAAI
errThakur, Sandeep Kumar; Roig, Nil; Monreal-Corona, Roger; Langer, Jens; Alonso, Mercedes; Harder, Sjoerd
err分享
err收藏
T-Shaped Palladium and Platinum {MNO}10 Nitrosyl Complexes
errINORGANIC CHEMISTRY
IF4.7
err2024-01-11
err4
errOAAI
errSinclair, Matthew J. G.; Roig, Nil; Gyton, Matthew R.; Tsoureas, Nikolaos; Cloke, F. Geoffrey N.; Alonso, Mercedes; Chaplin, Adrian B.
err分享
err收藏
Aromaticity and Magnetic Behavior in Benzenoids: Unraveling Ring Current Combinations苯类化合物中的芳香性和磁性行为: 解开环电流组合
errCHEMISTRY-A EUROPEAN JOURNAL
IF3.7
err2023-11-13
err13
errOAAI
errLeyva-Parra, Luis; Pino-Rios, Ricardo; Inostroza, Diego; Sola, Miquel; Alonso, Mercedes; Tiznado, William
err分享
err收藏
Application of Inverse Design Approaches to the Discovery of Nonlinear Optical Switches逆设计方法在发现非线性光开关中的应用
errMOLECULES
IF4.6
err2023-10-31
err2
errOAAI
errDesmedt, Eline; Serrano Gimenez, Lea; De Vleeschouwer, Freija; Alonso, Mercedes
err分享
err收藏
Mechanochemical Felkin-Anh Model: Achieving Forbidden Reaction Outcomes with Mechanical Force
errJOURNAL OF ORGANIC CHEMISTRY
IF3.6
err2023-02-03
err6
errOAAI
errAlonso, Mercedes; De Proft, Frank; Bettens, Tom; Geerlings, Paul
err分享
err收藏
Isomerism tunes the diradical character of difluorenopyrroles at constant Hückel-level anti-aromaticity
errCHEMICAL SCIENCE
IF7.4
err2023-01-01
err1
errOAAI
errMoriyasu, Ryotaro; Quintero, Sergio Moles; Gomez-Garcia, Carlos J.; Suzuki, Kazumasa; Kitamura, Chitoshi; Murata, Michihisa; Alonso, Mercedes; Casado, Juan; Kato, Shin-ichiro
err分享
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Does Supramolecular Gelation Require an External Trigger?
errGELS
IF5.3
err2022-12-10
err2
errOAAI
errVan Lommel, Ruben; Van Hooste, Julie; Vandaele, Johannes; Steurs, Gert; Van der Donck, Tom; De Proft, Frank; Rocha, Susana; Sakellariou, Dimitrios; Alonso, Mercedes; De Borggraeve, Wim M.
err分享
err收藏
Quest for the Most Aromatic Pathway in Charged Expanded Porphyrins
errCHEMISTRY-A EUROPEAN JOURNAL
IF3.7
err2022-11-28
err10
errOAAI
errCasademont-Reig, Irene; Woller, Tatiana; Garcia, Victor; Contreras-Garcia, Julia; Tiznado, William; Torrent-Sucarrat, Miquel; Matito, Eduard; Alonso, Mercedes
err分享
err收藏
Modulation of Metal Carbonyl Stretching Frequencies in the Second Coordination Sphere through the Internal Stark Effect通过内部Stark效应调制第二配位球中的羰基金属伸缩频率
errCHEMISTRY-A EUROPEAN JOURNAL
IF3.7
err2022-10-19
err4
errOAAI
errParker, Gemma L.; Van Lommel, Ruben; Roig, Nil; Alonso, Mercedes; Chaplin, Adrian B.
err分享
err收藏
SuFEx-enabled, chemoselective synthesis of triflates, triflamides and triflimidates
errCHEMICAL SCIENCE
IF7.4
err2022-01-01
err13
errOAAI
errLi, Bing-Yu; Voets, Lauren; Van Lommel, Ruben; Hoppenbrouwers, Fien; Alonso, Mercedes; Verhelst, Steven H. L.; De Borggraeve, Wim M.; Demaerel, Joachim
err分享
err收藏
Conceptual density functional theory under pressure: Part I. XP-PCM method applied to atoms
errCHEMICAL SCIENCE
IF7.4
err2022-01-01
err11
errOAAI
errEeckhoudt, J.; Bettens, T.; Geerlings, P.; Cammi, R.; Chen, B.; Alonso, M.; De Proft, F.
err分享
err收藏

研究方向

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合作学者
合作期刊
B
Bert M. Weckhuysen
H 指数: 134 · 论文数: 1.2K
P
Pavel Hobza
H 指数: 115 · 论文数: 704
J
Jan M. L. Martin
H 指数: 88 · 论文数: 552
F
F. Matthias Bickelhaupt
H 指数: 87 · 论文数: 1.5K
M
Miquel Solà
H 指数: 81 · 论文数: 767
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