• A modular olefination reaction between aldehydes and diborylsilylmethide lithium salts
• Salvado, Oriol; Fernandez, Elena
• CHEMICAL COMMUNICATIONS, 2021, 57, 6300-6303

• Alkoxide activation of tetra-alkoxy diboron reagents in C-B bond formation: a decade of unpredictable reactivity
• Carbo, Jorge J.; Fernandez, Elena
• CHEMICAL COMMUNICATIONS, 2021, 57, 11935-11947

• Assessing Methodologies to Synthesize alpha-Sulfenylated Carbonyl Compounds by Green Chemistry Metrics
• Margalef, Jessica; Samec, Joseph S. M.
• CHEMSUSCHEM, 2021, 14, 808-823

• Borata-Alkene Species as Nucleophilic Reservoir
• Maza, Ricardo J.; Carbo, Jorge J.; Fernandez, Elena
• ADVANCED SYNTHESIS & CATALYSIS, 2021, 363, 2274-2289

• Boron-Wittig olefination with gem-bis(boryl)alkanes
• Cuenca, Ana B.; Fernandez, Elena
• CHEMICAL SOCIETY REVIEWS, 2021, 50, 72-86

• Catalytic hydrogenation of furfural to tetrahydrofurfuryl alcohol using competitive nickel catalysts supported on mesoporous clays
• Sunyol, C.; Owen, R. English; Gonzalez, M. D.; Salagre, P.; Cesteros, Y.
• APPLIED CATALYSIS A-GENERAL, 2021, 611, -

• Computational study of the staircase molecular conductivity of polyoxovanadates adsorbed on Au(111)
• Notario-Estevez, Almudena; Lopez, Xavier; de Graaf, Coen
• DALTON TRANSACTIONS, 2021, 50, 5540-5551

• Cooperative NHC-based Catalytic System Immobilised onto Carbon Materials for the Cycloaddition of CO2 to Epoxides
• Souleymanou, Myriam Y.; El-Ouahabi, Fatima; Masdeu-Bulto, Anna M.; Godard, Cyril
• CHEMCATCHEM, 2021, 13, 1706-1710

• Crystal Structure and DFT Calculations of Zn(II)-NN ' O Schiff Base Complex
• Iksi, Siham; Guemmout, Farid El; Reguero, Mar; Masdeu-Bulto, Anna M.; Aghmiz, Ali
• JOURNAL OF CHEMICAL CRYSTALLOGRAPHY, 2021, 51, 432-437

• Deep learning: step forward to high-resolution in vivo shortwave infrared imaging
• Baulin, Vladimir A.; Usson, Yves; Le Guevel, Xavier
• JOURNAL OF BIOPHOTONICS, 2021, 0, -

• Density functional theory study of single-molecule ferroelectricity in Preyssler-type polyoxometalates
• Wang, Fei; Lang, Zhongling; Yan, Likai; Stroppa, Alessandro; Poblet, Josep M.; de Graaf, Coen
• APL MATERIALS, 2021, 9, -

• Density Functional Theory-Inspired Design of Ir/P,S-Catalysts for Asymmetric Hydrogenation of Olefins
• Faiges, Jorge; Borras, Carlota; Pastor, Isidro M.; Pamies, Oscar; Besora, Maria; Dieguez, Montserrat
• ORGANOMETALLICS, 2021, 40, 3424-3435

• Discovery and Supramolecular Interactions of Neutral Palladium-Oxo Clusters Pd-16 and Pd-24
• Bhattacharya, Saurav; Basu, Uttara; Haouas, Mohamed; Su, Pei; Espenship, Michael Forrester; Wang, Fei; Sole-Daura, Albert; Taffa, Dereje H.; Wark, Michael; Poblet, Josep M.; Laskin, Julia; Cadot, Emmanuel; Kortz, Ulrich
• ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 0, 60, 3632-3639

• Effect of the Size and Shape of Ho, Tm:KLu(WO4)(2) Nanoparticles on Their Self-Assessed Photothermal Properties
• Nexha, Albenc; Pujol, Maria Cinta; Carvajal, Joan Josep; Diaz, Francesc; Aguilo, Magdalena
• NANOMATERIALS, 2021, 11, -

• Evolution in heterodonor P-N, P-S and P-O chiral ligands for preparing efficient catalysts for asymmetric catalysis. From design to applications
• Margalef, Jessica; Biosca, Maria; de la Cruz Sanchez, Pol; Faiges, Jorge; Pamies, Oscar; Dieguez, Montserrat
• COORDINATION CHEMISTRY REVIEWS, 2021, 446, -

• Fabrication of colloidal platforms for surface-enhanced Raman spectroscopy on optically inert templates
• Blanco-Formoso, Maria; Pazos-Perez, Nicolas; Alvarez-Puebla, Ramon A.
• JOURNAL OF RAMAN SPECTROSCOPY, 2021, 52, 554-562

• Gating the conductance of extended metal atom chains: a computational analysis of Ru-3(dpa)(4)(NCS)(2) and [Ru-3(npa)(4)(NCS)(2)]
• Spivak, Mariano; de Graaf, Coen; Arcisauskaite, Vaida; Lopez, Xavier
• PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2021, 23, 14836-14844

• Gold-spiked coating of silver particles through cold nanowelding
• Calderon, Irene; Alvarez-Puebla, Ramon A.; Pazos-Perez, Nicolas
• NANOSCALE, 2021, 13, 4530-4536

• Indene Derived Phosphorus-Thioether Ligands for the Ir-Catalyzed Asymmetric Hydrogenation of Olefins with Diverse Substitution Patterns and Different Functional Groups
• Margalef, Jessica; Biosca, Maria; de la Cruz-Sanchez, Pol; Caldentey, Xisco; Rodriguez-Escrich, Carles; Pamies, Oscar; Pericas, Miquel A.; Dieguez, Montserrat
• ADVANCED SYNTHESIS & CATALYSIS, 2021, 363, 4561-4574

• Influence of the crystal packing in singlet fission: one step beyond the gas phase approximation
• Aguilar Suarez, Luis Enrique; de Graaf, Coen; Faraji, Shirin
• PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2021, 23, 14164-14177

• Insights from Adsorption and Electron Modification Studies of Polyoxometalates on Surfaces for Molecular Memory Applications
• Moors, Marco; Warneke, Jonas; Lopez, Xavier; de Graaf, Coen; Abel, Bernd; Monakhov, Kirill Yu
• ACCOUNTS OF CHEMICAL RESEARCH, 2021, 54, 3377-3389

• Iridium-Catalyzed Asymmetric Hydrogenation
• Margalef, Jessica; Pamies, Oscar; Dieguez, Montserrat
• IRIDIUM CATALYSTS FOR ORGANIC REACTIONS, 2021, 69, 153-205

• Iridium-Catalyzed Undirected Homogeneous C-H Borylation Reaction
• Fernandez, Elena
• IRIDIUM CATALYSTS FOR ORGANIC REACTIONS, 2021, 69, 207-225

• Lanthanide doped luminescence nanothermometers in the biological windows: strategies and applications
• Nexha, Albenc; Carvajal, Joan Josep; Pujol, Maria Cinta; Diaz, Francesc; Aguilo, Magdalena
• NANOSCALE, 2021, 13, 7913-7987

• Lignocellulosic residues as catalysts for CO(2)fixation: complementary experimental and computational approaches
• El Ouahabi, Mohamed Said; Bin Yeamin, Md; Rivas, Raquel; El Guemmout, Farid; Reguero, Mar; Masdeu-Bulto, Anna M.; Aghmiz, Ali
• CELLULOSE, 2021, 28, 359-375

• Mapping the Electronic Structure and the Reactivity Trends for Stabilized alpha-Boryl Carbanions
• Maza, Ricardo J.; Fernandez, Elena; Carbo, Jorge J.
• CHEMISTRY-A EUROPEAN JOURNAL, 2021, 27, 12352-12361

• Mechano-bactericidal actions of nanostructured surfaces
• Linklater, Denver P.; Baulin, Vladimir A.; Juodkazis, Saulius; Crawford, Russell J.; Stoodley, Paul; Ivanova, Elena P.
• NATURE REVIEWS MICROBIOLOGY, 0, 19, 8-22

• Metal complexes bearing ONO ligands as highly active catalysts in carbon dioxide and epoxide coupling reactions
• Munoz, Bianca K.; Viciano, Monica; Godard, Cyril; Castillon, Sergio; Garcia-Ruiz, Monica; Gonzalez, Ma Dolores Blanco; Claver, Carmen
• INORGANICA CHIMICA ACTA, 2021, 517, -

• Microplastics destabilize lipid membranes by mechanical stretching
• Fleury, Jean-Baptiste; Baulin, Vladimir A.
• PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA, 2021, 118, -

• Molecular Transition Metal Oxide Electrocatalysts for the Reversible Carbon Dioxide-Carbon Monoxide Transformation
• Azaiza-Dabbah, Dima; Vogt, Charlotte; Wang, Fei; Masip-Sanchez, Albert; Graaf, Coen; Poblet, Josep M.; Haviv, Eynat; Neumann, Ronny
• ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 2021, 0, -

• N=N Bond Cleavage by Tantalum Hydride Complexes: Mechanistic Insights and Reactivity
• Alvarez-Ruiz, Elena; Carbo, Jorge J.; Gomez, Manuel; Hernandez-Prieto, Cristina; Hernan-Gomez, Alberto; Martin, Avelino; Mena, Miguel; Ricart, Josep M.; Salom-Catala, Antoni; Santamaria, Cristina
• INORGANIC CHEMISTRY, 2021, 0, -

• Pd, Cu and Bimetallic PdCu NPs Supported on CNTs and Phosphine-Functionalized Silica: One-Pot Preparation, Characterization and Testing in the Semi-Hydrogenation of Alkynes
• Sanchez-Resa, Daniel; Delgado, Jorge A.; Fernandez-Martinez, Maria Dolores; Didelot, Chloe; De Mallmann, Aimery; Szeto, Kai C.; Taoufik, Mostafa; Claver, Carmen; Godard, Cyril
• EUROPEAN JOURNAL OF INORGANIC CHEMISTRY, 2021, 2021, 4970-4978

• Peptide Hydrolysis by Metal (Oxa)cyclen Complexes: Revisiting the Mechanism and Assessing Ligand Effects
• Norjmaa, Gantulga; Sole-Daura, Albert; Besora, Maria; Ricart, Josep M.; Carbo, Jorge J.
• INORGANIC CHEMISTRY, 2021, 60, 808-816

• Photoreduction Mechanism of CO2 to CO Catalyzed by a Three-Component Hybrid Construct with a Bimetallic Rhenium Catalyst
• Wang, Fei; Neumann, Ronny; de Graaf, Coen; Poblet, Josep M.
• ACS CATALYSIS, 2021, 11, 1495-1504

• Positively-charged plasmonic nanostructures for SERS sensing applications
• Turino, Mariacristina; Pazos-Perez, Nicolas; Guerrini, Luca; Alvarez-Puebla, Ramon A.
• RSC ADVANCES, 2021, 12, 845-859

• Reaction Pathway Discrimination in Alkene Oxidation Reactions by Designed Ti-Siloxy-Polyoxometalates
• Zhang, Teng; Sole-Daura, Albert; Fouilloux, Hugo; Poblet, Josep M.; Proust, Anna; Carbo, Jorge J.; Guillemot, Geoffroy
• CHEMCATCHEM, 2021, 13, 1220-1229

• Reactivity Trends with Borylalkyl Copper(I) Species
• Corro, Macarena; Salvado, Oriol; Gonzalez, Sara; Dominguez-Molano, Paula; Fernandez, Elena
• EUROPEAN JOURNAL OF INORGANIC CHEMISTRY, 2021, 2021, 2802-2813

• Seeking the Optimal Descriptor for S(N)2 Reactions through Statistical Analysis of Density Functional Theory Results
• Moran-Gonzalez, Lucia; Besora, Maria; Maseras, Feliu
• JOURNAL OF ORGANIC CHEMISTRY, 2021, 0, -

• Self-Adaptable Tropos Catalysts
• Dieguez, Montserrat; Pamies, Oscar; Moberg, Christina
• ACCOUNTS OF CHEMICAL RESEARCH, 2021, 54, 3252-3263

• Silver melamine thin film as a flexible platform for SERS analysis
• Nenashkina, Anastasia; Koltsov, Semyon; Orlova, Olga Yu; Nikitina, Anna A.; Kirilenko, Demid A.; Andreeva, Daria, V; Blanco-Formoso, Maria; Pazos-Perez, Nicolas; Alvarez-Puebla, Ramon; Skorb, Ekaterina, V
• NANOSCALE, 2021, 13, 7375-7380

• Spontaneous and stimulated electron-photon interactions in nanoscale plasmonic near fields
• Liebtrau, Matthias; Sivis, Murat; Feist, Armin; Lourenco-Martins, Hugo; Pazos-Perez, Nicolas; Alvarez-Puebla, Ramon A.; Garcia de Abajo, F. Javier; Polman, Albert; Ropers, Claus
• LIGHT-SCIENCE & APPLICATIONS, 2021, 10, -

• Structural Recognition of Triple-Stranded DNA by Surface-Enhanced Raman Spectroscopy
• Guerrini, Luca; Alvarez-Puebla, Ramon A.
• NANOMATERIALS, 2021, 11, -

• Surface-Enhanced Raman Scattering Sensing of Transition Metal Ions in Waters
• Guerrini, Luca; Alvarez-Puebla, Ramon A.
• ACS OMEGA, 2021, 6, 1054-1063

• Synthesis of monoclinic Ho,Tm:KLu(WO4)(2) microrods with high photothermal conversion efficiency via a thermal decomposition-assisted method
• Nexha, Albenc; Carvajal, Joan J.; Cinta Pujol, Maria; Diaz, Francesc; Aguilo, Magdalena
• JOURNAL OF MATERIALS CHEMISTRY C, 2021, 9, 2024-2036

• Tailoring Wettability Properties of GaN Epitaxial Layers through Surface Porosity Induced during CVD Deposition
• Mena, Josue; Carvajal, Joan J.; Zubialevich, Vitaly; Parbrook, Peter J.; Diaz, Francesc; Aguilo, Magdalena
• LANGMUIR, 2021, 0, -

• Targets and Tools: Nucleic Acids for Surface-Enhanced Raman Spectroscopy
• Calderon, Irene; Guerrini, Luca; Alvarez-Puebla, Ramon A.
• BIOSENSORS-BASEL, 2021, 11, -

• Transannular Enantioselective (3 + 2) Cycloaddition of Cycloalkenone Hydrazones under Bronsted Acid Catalysis.
• Sendra, Jana; Reyes, Efraim; Prieto, Liher; Fernandez, Elena; Vicario, Jose L
• Organic letters, 2021, 23, 8738-8743

• Transborylation of alkenylboranes with diboranes
• Dominguez-Molano, Paula; Bru, Gerard; Salvado, Oriol; Maza, Ricardo J.; Carbo, Jorge J.; Fernandez, Elena
• CHEMICAL COMMUNICATIONS, 2021, 57, 13361-13364

• Two Copper-Carbenes from One Diazo Compound
• Alvarez, Maria; Besora, Maria; Molina, Francisco; Maseras, Feliu; Belderrain, Tomas R.; Perez, Pedro J.
• JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2021, 143, 4837-4843

• Ultrafast Intersystem Crossing in Xanthone from Wavepacket Dynamics
• Alias-Rodriguez, Marc; de Graaf, Coen; Huix-Rotllant, Miquel
• JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2021, 0, -

• Understanding polyoxometalates as water oxidation catalysts through iron vs. cobalt reactivity
• Azmani, Khalid; Besora, Maria; Soriano-Lopez, Joaquin; Landolsi, Meriem; Teillout, Anne-Lucie; de Oliveira, Pedro; Mbomekalle, Israel-Martyr; Poblet, Josep M.; Galan-Mascaros, Jose-Ramon
• CHEMICAL SCIENCE, 2021, 0, -

• Understanding the Binding Properties of N-heterocyclic Carbenes through BDE Matrix App
• Moran-Gonzalez, Lucia; Pedregal, Jaime Rodriguez-Guerra; Besora, Maria; Maseras, Feliu
• EUROPEAN JOURNAL OF INORGANIC CHEMISTRY, 2021, 0, -

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