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

On the Redox Mechanism of Low‐Temperature NH3‐SCR over Cu‐CHA: A Combined Experimental and Theoretical Study of the Reduction Half Cycle

(2021) Wenshuo Hu et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Revisiting the Extended X-ray Absorption Fine Structure Fitting Procedure through a Machine Learning-Based Approach

(2021) A. Martini et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Copper Pairing in the Mordenite Framework as a Function of the Cu I /Cu II Speciation

(2021) Gabriele Deplano et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

First-Principles Microkinetic Model for Low-Temperature NH3-Assisted Selective Catalytic Reduction of NO over Cu-CHA

(2021) Yingxin Feng et al.   ACS Catalysis

Understanding X-ray absorption spectra by means of descriptors and machine learning algorithms

(2021) A. A. Guda et al.   npj Computational Materials

A Complete Multisite Reaction Mechanism for Low-Temperature NH3-SCR over Cu-CHA

(2020) Lin Chen et al.   ACS Catalysis

Combining Kinetics and Operando Spectroscopy to Interrogate the Mechanism and Active Site Requirements of NOx Selective Catalytic Reduction with NH3 on Cu-Zeolites

(2020) Siddarth H. Krishna et al.   Journal of Physical Chemistry Letters

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

(2020) Chiara Negri et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Spectroscopic Evidence of Efficient Generation of Dicopper Intermediate in Selective Catalytic Reduction of NO over Cu-Ion-Exchanged Zeolites

(2020) Akira Oda et al.   ACS Catalysis

Continuous Partial Oxidation of Methane to Methanol Catalyzed by Diffusion-Paired Copper Dimers in Copper-Exchanged Zeolites

(2019) Kimberly T. Dinh et al.   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

(2019) Ilia A. Pankin et al.   CATALYSIS TODAY

PyFitit: The software for quantitative analysis of XANES spectra using machine-learning algorithms

(2019) A. Martini et al.   COMPUTER PHYSICS COMMUNICATIONS

Activation of oxygen on (NH 3 Cu NH 3 ) + in NH 3 -SCR over Cu-CHA

(2018) Lin Chen et al.   JOURNAL OF CATALYSIS

Recent Progress in Atomic-Level Understanding of Cu/SSZ-13 Selective Catalytic Reduction Catalysts

(2018) et al.   Catalysts

Cu-CHA – a model system for applied selective redox catalysis

(2018) Elisa Borfecchia et al.   CHEMICAL SOCIETY REVIEWS

Selective Catalytic Reduction over Cu/SSZ-13: Linking Homo- and Heterogeneous Catalysis

(2017) Feng Gao et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

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

(2017) Dimitrios K. Pappas et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Dynamic multinuclear sites formed by mobilized copper ions in NOxselective catalytic reduction

(2017) Christopher Paolucci et al.   SCIENCE

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

(2017) A. Martini et al.   Chemical Science

Controlling the Isolation and Pairing of Aluminum in Chabazite Zeolites Using Mixtures of Organic and Inorganic Structure-Directing Agents

(2016) John R. Di Iorio et al.   CHEMISTRY OF MATERIALS

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

(2016) Kirill A. Lomachenko et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Catalysis in a Cage: Condition-Dependent Speciation and Dynamics of Exchanged Cu Cations in SSZ-13 Zeolites

(2016) Christopher Paolucci et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Recent advances in automotive catalysis for NOx emission control by small-pore microporous materials

(2015) A. M. Beale et al.   CHEMICAL SOCIETY REVIEWS

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

(2015) Ton V. W. Janssens et al.   ACS Catalysis

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

(2014) Filippo Giordanino et al.   Journal of Physical Chemistry Letters

Wavelet data analysis of EXAFS spectra

(2008) J. Timoshenko et al.   COMPUTER PHYSICS COMMUNICATIONS