K. Lomachenko

发表

Quantitative structural determination of active sites from in situ and operando XANES spectra: From standard ab initio simulations to chemometric and machine learning approaches

E. Borfecchia, C. Lamberti, L. Braglia, 2019, Catalysis Today.

frameworks: structure, properties, methods of synthesis and characterization

C. Lamberti, A. Guda, A. Guda, 2022 .

Optimized Finite Difference Method for the Full-Potential XANES Simulations: Application to Molecular Adsorption Geometries in MOFs and Metal-Ligand Intersystem Crossing Transients.

C. Lamberti, A. Guda, S. Guda, 2015, Journal of chemical theory and computation.

Reversible Capture and Release of Cl2 and Br2 with a Redox-Active Metal-Organic Framework.

Christopher H. Hendon, Craig M. Brown, E. Borfecchia, 2017, Journal of the American Chemical Society.

Pd hydride and carbide studied by means of Pd K-edge X-ray absorption near-edge structure analysis

A. Guda, A. Bugaev, K. Lomachenko, 2015 .

Temperature- and Pressure-Dependent Hydrogen Concentration in Supported PdHx Nanoparticles by Pd K-Edge X-ray Absorption Spectroscopy

J. Bokhoven, C. Lamberti, A. Guda, 2014 .

Palladium Carbide and Hydride Formation in the Bulk and at the Surface of Palladium Nanoparticles

J. Bokhoven, C. Lamberti, A. Guda, 2018 .

Core–Shell Structure of Palladium Hydride Nanoparticles Revealed by Combined X-ray Absorption Spectroscopy and X-ray Diffraction

J. Bokhoven, C. Lamberti, A. Guda, 2017 .

Investigating the role of Cu-oxo species in Cu-nitrate formation over Cu-CHA catalysts

E. Borfecchia, S. Bordiga, K. Lomachenko, 2021, Physical chemistry chemical physics : PCCP.

Quo vadis niobium? Divergent coordination behavior of early-transition metals towards MOF-5† †Electronic supplementary information (ESI) available. See DOI: 10.1039/c9sc01553a

Christopher H. Hendon, E. Borfecchia, C. Lamberti, 2019, Chemical science.

Exact Stoichiometry of Ce xZr6- x Cornerstones in Mixed-Metal UiO-66 Metal-Organic Frameworks Revealed by Extended X-ray Absorption Fine Structure Spectroscopy.

C. Lamberti, F. Bonino, S. Bordiga, 2018, Journal of the American Chemical Society.

High Zn/Al ratios enhance dehydrogenation vs hydrogen transfer reactions of Zn-ZSM-5 catalytic systems in methanol conversion to aromatics

E. Borfecchia, C. Lamberti, P. Beato, 2018 .

Finding the active species: The conversion of methanol to aromatics over Zn-ZSM-5/alumina shaped catalysts

E. Borfecchia, P. Beato, S. Bordiga, 2020 .

Hydrogenation of ethylene over palladium: evolution of the catalyst structure by operando synchrotron-based techniques.

A. Guda, E. Groppo, M. Brunelli, 2021, Faraday discussions.

Time-dependent carbide phase formation in palladium nanoparticles

C. Lamberti, A. Guda, A. Soldatov, 2020 .

In situ X-ray absorption spectroscopy data during formation of active Pt- and Pd-sites in functionalized UiO-67 metal-organic frameworks

C. Lamberti, A. Guda, A. Bugaev, 2019, Data in brief.

Kinetics of the Atomic Structure of Palladium Nanoparticles during the Desorption of Hydrogen According to X-Ray Diffraction

A. Guda, A. Bugaev, K. Lomachenko, 2019, JETP Letters.

Evolution of Pt and Pd species in functionalized UiO-67 metal-organic frameworks

K. Lillerud, C. Lamberti, L. Braglia, 2019, Catalysis Today.

Operando study of palladium nanoparticles inside UiO-67 MOF for catalytic hydrogenation of hydrocarbons.

K. Lillerud, C. Lamberti, L. Braglia, 2018, Faraday discussions.

Disclosing the Properties of a New Ce(III)-Based MOF: Ce2(NDC)3(DMF)2

C. Lamberti, F. Bonino, N. Stock, 2018, Crystal Growth & Design.

Experimental and theoretical study of hydrogen desorption process from Mn ( BH 4 ) 2

Y. Filinchuk, C. Lamberti, A. Guda, 2017 .

Modulator Effect in UiO-66-NDC (1,4-Naphthalenedicarboxylic Acid) Synthesis and Comparison with UiO-67-NDC Isoreticular Metal–Organic Frameworks

K. Lillerud, C. Lamberti, A. Guda, 2017 .

In situ formation of hydrides and carbides in palladium catalyst: When XANES is better than EXAFS and XRD

J. Bokhoven, C. Lamberti, A. Guda, 2017 .

CO 2 hydrogenation to methanol and hydrocarbons over bifunctional Zn-doped ZrO 2 / zeolite catalysts †

J. Gascón, L. Cavallo, E. Borfecchia, 2020 .

Solvent-Driven Gate Opening in MOF-76-Ce: Effect on CO2 Adsorption.

K. Lillerud, C. Lamberti, F. Bonino, 2016, ChemSusChem.

Tuning Pt and Cu sites population inside functionalized UiO-67 MOF by controlling activation conditions.

K. Lillerud, E. Borfecchia, C. Lamberti, 2017, Faraday discussions.

Co-Ligand Dependent Formation and Phase Transformation of Four Porphyrin-Based Cerium Metal–Organic Frameworks

K. Lillerud, N. Stock, K. Lomachenko, 2017 .

Comparing the Nature of Active Sites in Cu-loaded SAPO-34 and SSZ-13 for the Direct Conversion of Methane to Methanol

Dimitrios K. Pappas, E. Borfecchia, B. Arstad, 2020 .

Cu-Exchanged Ferrierite Zeolite for the Direct CH4 to CH3OH Conversion: Insights on Cu Speciation from X-Ray Absorption Spectroscopy

Dimitrios K. Pappas, E. Borfecchia, C. Lamberti, 2019, Topics in Catalysis.

Evolution of active sites during selective oxidation of methane to methanol over Cu-CHA and Cu-MOR zeolites as monitored by operando XAS

Dimitrios K. Pappas, E. Borfecchia, M. Signorile, 2019, Catalysis Today.

Active sites in Cu-SSZ-13 deNOx catalyst under reaction conditions: a XAS/XES perspective

E. Borfecchia, C. Lamberti, P. Beato, 2016 .

A Titanium(IV)‐Based Metal–Organic Framework Featuring Defect‐Rich Ti‐O Sheets as an Oxidative Desulfurization Catalyst

M. Roeffaers, S. Bals, G. Mali, 2019, Angewandte Chemie.

A Titanium(IV)-based Metal-Organic Framework Featuring Defect-Rich Ti-O Sheets as an Oxidative Desulfurization Catalyst.

M. Roeffaers, D. D. De Vos, S. Bals, 2019, Angewandte Chemie.

Evidence of Mixed‐Ligand Complexes in Cu−CHA by Reaction of Cu Nitrates with NO/NH3 at Low Temperature

E. Borfecchia, S. Bordiga, K. Lomachenko, 2019, ChemCatChem.

Spin-State Transition, Magnetism and Local Crystal Structure in Eu1-xCaxCoO3-δ

J. M. Chen, J. Lin, S. Streltsov, 2012, 1210.1289.

Spectroscopic Methods in Catalysis and Their Application in Well-Defined Nanocatalysts

E. Borfecchia, C. Lamberti, A. Guda, 2017 .

In situ X-ray absorption study of Cu species in Cu-CHA catalysts for NH3-SCR during temperature-programmed reduction in NO/NH3

E. Borfecchia, S. Bordiga, K. Lomachenko, 2021, Research on Chemical Intermediates.

Temperature-dependent dynamics of NH3-derived Cu species in the Cu-CHA SCR catalyst

E. Borfecchia, C. Lamberti, K. Lomachenko, 2019, Reaction Chemistry & Engineering.

The Cu-CHA deNOx Catalyst in Action: Temperature-Dependent NH3-Assisted Selective Catalytic Reduction Monitored by Operando XAS and XES.

E. Borfecchia, C. Lamberti, P. Beato, 2016, Journal of the American Chemical Society.

A Consistent Reaction Scheme for the Selective Catalytic Reduction of Nitrogen Oxides with Ammonia

Elisa Borfecchia, Kirill A. Lomachenko, Carlo Lamberti, 2015 .

Interaction of NH3 with Cu-SSZ-13 Catalyst: A Complementary FTIR, XANES, and XES Study.

E. Borfecchia, C. Lamberti, P. Beato, 2014, The journal of physical chemistry letters.

Cerium-based metal organic frameworks with UiO-66 architecture: synthesis, properties and redox catalytic activity.

D. Vos, N. Stock, K. Lomachenko, 2015, Chemical communications.

Revisiting the nature of Cu sites in the activated Cu-SSZ-13 catalyst for SCR reaction† †Electronic supplementary information (ESI) available: experimental section (sample description, in situ FTIR spectroscopy, synchrotron characterization, DFT-based analysis of XAS and XES data); XAS of hydrated C

A. V. Soldatov, E. Borfecchia, C. Lamberti, 2014, Chemical science.

EXAFS wavelet transform analysis of Cu-MOR zeolites for the direct methane to methanol conversion.

E. Borfecchia, P. Beato, S. Bordiga, 2020, Physical chemistry chemical physics : PCCP.

Probing Reactive Platinum Sites in UiO-67 Zirconium Metal–Organic Frameworks

K. Lillerud, E. Borfecchia, C. Lamberti, 2015 .

XAS and XES Techniques Shed Light on the Dark Side of Ziegler–Natta Catalysts: Active‐Site Generation

P. Glatzel, C. Lamberti, W. Bras, 2015 .

XAS and XES techniques try to shed light on the dark side of Ziegler-Natta catalysts: active sites generation

P. Glatzel, C. Lamberti, W. Bras, 2022 .

Advanced X‐ray Absorption Spectroscopy Analysis to Determine Structure‐Activity Relationships for Cu‐Zeolites in the Direct Conversion of Methane to Methanol

Dimitrios K. Pappas, E. Borfecchia, K. Lomachenko, 2020 .

Understanding and Optimizing the Performance of Cu‐FER for The Direct CH4 to CH3OH Conversion

Dimitrios K. Pappas, Elisa Borfecchia, Michael Dyballa, 2018, ChemCatChem.

Exploring structure and reactivity of Cu sites in functionalized UiO-67 MOFs

K. Lillerud, E. Borfecchia, C. Lamberti, 2017 .

Cerium(III) Nitrate Derived CeO2 Support Stabilising PtOx Active Species for Room Temperature CO Oxidation

K. Lomachenko, E. Gerasimov, S. Korenev, 2020 .

Dynamics of Reactive Species and Reactant-Induced Reconstruction of Pt Clusters in Pt/Al2O3 Catalysts

C. Lamberti, E. Groppo, K. Lomachenko, 2019, ACS Catalysis.

Unravelling the Redox-catalytic Behavior of Ce4+ Metal-Organic Frameworks by X-ray Absorption Spectroscopy.

M. Roeffaers, D. D. De Vos, C. Lamberti, 2018, Chemphyschem : a European journal of chemical physics and physical chemistry.

Structure and Reactivity of Oxygen-Bridged Diamino Dicopper(II) Complexes in Cu-Ion-Exchanged Chabazite Catalyst for NH3-Mediated Selective Catalytic Reduction

E. Borfecchia, S. Bordiga, K. Lomachenko, 2020, Journal of the American Chemical Society.

Identifying Cu-oxo species in Cu-zeolites by XAS: A theoretical survey by DFT-assisted XANES simulation and EXAFS wavelet transform

E. Borfecchia, S. Bordiga, K. Lomachenko, 2020 .

SO2 Poisoning of Cu-CHA deNOx Catalyst: The Most Vulnerable Cu Species Identified by X-ray Absorption Spectroscopy

Peter N. R. Vennestrøm, E. Borfecchia, S. Bordiga, 2022, JACS Au.

Energy and Environmental Science at ESRF

K. Lomachenko, O. Mathon, R. Tucoulou, 2020 .

Influence of Cu-speciation in mordenite on direct methane to methanol conversion: Multi-Technique characterization and comparison with NH3 selective catalytic reduction of NOx

Dimitrios K. Pappas, E. Borfecchia, B. Arstad, 2020 .

Composition-driven Cu-speciation and reducibility in Cu-CHA zeolite catalysts: a multivariate XAS/FTIR approach to complexity

E. Borfecchia, C. Lamberti, P. Beato, 2017, Chemical science.

Methane to Methanol: Structure-Activity Relationships for Cu-CHA.

Dimitrios K. Pappas, K. Lillerud, E. Borfecchia, 2017, Journal of the American Chemical Society.

The impact of reaction conditions and material composition on the stepwise methane to methanol conversion over Cu-MOR: An operando XAS study

Dimitrios K. Pappas, E. Borfecchia, C. Lamberti, 2019, Catalysis Today.

Nitrate–nitrite equilibrium in the reaction of NO with a Cu-CHA catalyst for NH3-SCR

E. Borfecchia, C. Lamberti, P. Beato, 2016 .

Investigation of the nanoscale two-component ZnS-ZnO heterostructures by means of HR-TEM and X-ray based analysis

C. Lamberti, A. Guda, A. Guda, 2018, Journal of Solid State Chemistry.

X-ray absorption spectroscopy determination of the products of manganese borohydride decomposition upon heating

A. Guda, A. Guda, A. Soldatov, 2015 .

The Nuclearity of the Active Site for Methane to Methanol Conversion in Cu-Mordenite: A Quantitative Assessment.

Dimitrios K. Pappas, P. Glatzel, E. Borfecchia, 2018, Journal of the American Chemical Society.

CO2 hydrogenation to methanol and hydrocarbons over bifunctional Zn-doped ZrO2/zeolite catalysts

J. Gascón, L. Cavallo, E. Borfecchia, 2021 .

Hampered PdO Redox Dynamics by Water Suppresses Lean Methane Oxidation over Realistic Palladium Catalysts

M. Skoglundh, G. Smedler, P. Carlsson, 2021, ChemCatChem.

Synthesis of M-UiO-66 (M = Zr, Ce or Hf) employing 2,5-pyridinedicarboxylic acid as a linker: defect chemistry, framework hydrophilisation and sorption properties.

C. Lamberti, N. Stock, K. Lomachenko, 2018, Dalton transactions.

Synthesis, Crystal Structure, and Photocatalytic Properties of Two Isoreticular Ce(IV)-MOFs with an Infinite Rod-Shaped Inorganic Building Unit.

N. Stock, K. Lomachenko, C. Atzori, 2023, Inorganic chemistry.

New Opportunities for Earth Science at the Extremely Brilliant Source of the European Synchrotron Radiation Facility

G. Morard, M. Mezouar, K. Lomachenko, 2022, Synchrotron Radiation News.

Engineering the Charge Density on an In2.77S4/Porous Organic Polymer Hybrid Photocatalyst for CO2-to-Ethylene Conversion Reaction.

Ashutosh Kumar Singh, J. Mondal, K. Lomachenko, 2022, Journal of the American Chemical Society.

Atomic and electronic structure of free niobium nanoclusters: Simulation of the M4,5-XANES spectrum of Nb13+

K. Lomachenko, A. Soldatov, G. Niedner‐Schatteburg, 2014 .

Speciation of Ru Molecular Complexes in a Homogeneous Catalytic System: Fingerprint XANES Analysis Guided by Machine Learning

D. D. De Vos, A. Guda, A. Soldatov, 2021, The Journal of Physical Chemistry C.

Cu- and Fe-speciation in a composite zeolite catalyst for selective catalytic reduction of NOx: insights from operando XAS

V. Valtchev, C. Lamberti, S. Bordiga, 2021, Catalysis Science & Technology.

Photoactivated Osmium Arene Anticancer Complexes.

P. Sadler, A. Habtemariam, C. Garino, 2021, Inorganic chemistry.

Probing Structure and Reactivity of Metal Centers in Metal–Organic Frameworks by XAS Techniques

K. Lillerud, E. Borfecchia, J. Bokhoven, 2017 .

Structure and reactivity of oxygen-bridged diamino dicopper (II) complexes in Cu-CHA catalyst for NH3-SCR.

E. Borfecchia, S. Bordiga, K. Lomachenko, 2020, Journal of the American Chemical Society.

Hydride phase formation in carbon supported palladium hydride nanoparticles by in situ EXAFS and XRD

C. Lamberti, A. Guda, A. Soldatov, 2016 .

Time-resolved operando studies of carbon supported Pd nanoparticles under hydrogenation reactions by X-ray diffraction and absorption.

C. Lamberti, A. Guda, E. Groppo, 2018, Faraday discussions.

High energy resolution core-level X-ray spectroscopy for electronic and structural characterization of osmium compounds.

P. Glatzel, C. Garino, R. Gobetto, 2013, Physical chemistry chemical physics : PCCP.

Tandem CO2 Valorization and Ethane Dehydrogenation: Elucidating the Nature of Highly Selective Iron Oxide Active Sites

A. Lemonidou, K. Lomachenko, A. Longo, 2023, ACS Catalysis.

The duality of UiO-67-Pt MOFs: connecting treatment conditions and encapsulated Pt species by operando XAS.

K. Lillerud, E. Borfecchia, C. Lamberti, 2017, Physical chemistry chemical physics : PCCP.

Temperature- and Pressure-Dependent Hydrogen Concentration in Supported PdH_x Nanoparticles by Pd K-Edge X-ray Absorption Spectroscopy

J. Bokhoven, C. Lamberti, A. Guda, 2014 .

Bimetallic hexanuclear clusters in Ce/Zr-UiO-66 MOFs: in situ FTIR spectroscopy and modelling insights.

F. Bonino, S. Bordiga, N. Stock, 2020, Dalton transactions.

Wavelet analysis of a Cu-oxo zeolite EXAFS simulated spectrum

E. Borfecchia, K. Lomachenko, I. Pankin, 2020 .

Assessing the Influence of Zeolite Composition on Oxygen-Bridged Diamino Dicopper(II) Complexes in Cu-CHA DeNOx Catalysts by Machine Learning-Assisted X-ray Absorption Spectroscopy

E. Borfecchia, S. Bordiga, K. Lomachenko, 2022, The journal of physical chemistry letters.

Cooperative CO2 adsorption mechanism in a perfluorinated CeIV-based metal organic framework

M. Signorile, V. Crocellà, K. Lomachenko, 2023, Journal of materials chemistry. A.

Solubility and Stability of Hexanuclear Ce(IV)–O Clusters

N. Stock, K. Lomachenko, C. Atzori, 2023, Chemistry of Materials.

DFT-assisted XANES simulations to discriminate different monomeric CuII species in CHA catalysts

E. Borfecchia, C. Lamberti, K. Lomachenko, 2020 .

Finite difference method accelerated with sparse solvers for structural analysis of the metal-organic complexes

C. Lamberti, A. Guda, A. Soldatov, 2016 .

Versatile and high temperature spectroscopic cell for operando fluorescence and transmission x-ray absorption spectroscopic studies of heterogeneous catalysts.

J. Grunwaldt, K. Lomachenko, M. Casapu, 2021, The Review of scientific instruments.

Quantification of Adsorbates by X-ray Absorption Spectroscopy: Getting TGA-like Information for Free

K. Lomachenko, C. Atzori, O. Mathon, 2022, The journal of physical chemistry. C, Nanomaterials and interfaces.

Operando study of palladium nanoparticles inside UiO-67 MOF for catalytic hydrogenation of hydrocarbons.

K. Lillerud, C. Lamberti, A. Guda, 2018, Faraday discussions.

A XAFS study of the local environment and reactivity of Pt- sites in functionalized UiO-67 MOFs

K. Lillerud, E. Borfecchia, C. Lamberti, 2016 .

XAS on Rh and Ir metal sites in post synthetically functionalized UiO-67 Zirconium MOFs

K. Lillerud, E. Borfecchia, C. Lamberti, 2016 .

Quo vadis niobium? Divergent coordination behavior of early-transition metals towards MOF-5

Christopher H. Hendon, E. Borfecchia, C. Lamberti, 2019, Chemical science.

Exact Stoichiometry of Ce xZr6- x Cornerstones in Mixed-Metal UiO-66 Metal-Organic Frameworks Revealed by Extended X-ray Absorption Fine Structure Spectroscopy.

C. Lamberti, F. Bonino, S. Bordiga, 2018, Journal of the American Chemical Society.

Revisiting the nature of Cu sites in the activated Cu-SSZ-13 catalyst for SCR reaction

E. Borfecchia, C. Lamberti, P. Beato, 2014, Chemical science.

Local structure of Cu(I) ions in the MOR zeolite: A DFT-assisted XAS study

Dimitrios K. Pappas, E. Borfecchia, K. Lomachenko, 2020 .

The Nuclearity of the Active Site for Methane to Methanol Conversion in Cu-Mordenite: A Quantitative Assessment.

Dimitrios K. Pappas, P. Glatzel, E. Borfecchia, 2018, Journal of the American Chemical Society.

Experimental and theoretical study of hydrogen desorption process from Mn(BH4)2

Y. Filinchuk, C. Lamberti, A. Guda, 2018 .

Metal-organic frameworks: structure, properties, methods of synthesis and characterization

A. Guda, V. Butova, M. Soldatov, 2016 .

Discovery and In Situ Crystallization Studies of Cerium-Based Metal-Organic Frameworks with V-Shaped Linker Molecules.

V. Crocellà, N. Stock, K. Lomachenko, 2023, Inorganic chemistry.

Optimized Finite Difference Method for the Full-Potential XANES Simulations: Application to Molecular Adsorption Geometries in MOFs and Metal-Ligand Intersystem Crossing Transients.

C. Lamberti, A. Guda, S. Guda, 2015, Journal of chemical theory and computation.