The nature of cationic adsorption sites in alkaline zeolites—single, dual and multiple cation sites

Theoretical studies of Na+ location in ZSM-5: Model selection for accurate coordination structure and energetics

(2011) Zhen-Kun Chu et al.   CATALYSIS TODAY

Variable-Temperature IR Spectroscopic and Theoretical Studies on CO2 Adsorbed in Zeolite K-FER

(2011) Carlos Otero Areán et al.   CHEMPHYSCHEM

Carbon monoxide, dinitrogen and carbon dioxide adsorption on zeolite H-Beta: IR spectroscopic and thermodynamic studies

(2011) Montserrat Rodriguez Delgado et al.   ENERGY

Use of zeolites for greener and more para-selective electrophilic aromatic substitution reactions

(2011) Keith Smith et al.   GREEN CHEMISTRY

Role of extraframework metal sites for hydrogen adsorption into the pores of a zeolite: FT-IR study

(2011) Olena Zavorotynska et al.   INTERNATIONAL JOURNAL OF HYDROGEN ENERGY

Combined Experimental and Theoretical Investigations of Heterogeneous Dual Cation Sites in Cu,M-FER Zeolites

(2011) Roman Bulanek et al.   Journal of Physical Chemistry C

H-Bonding of Zeolite Hydroxyls with Weak Bases: FTIR Study of CO and N2 Adsorption on H-D-ZSM-5

(2011) Kristina Chakarova et al.   Journal of Physical Chemistry C

Combined volumetric, infrared spectroscopic and theoretical investigation of CO2 adsorption on Na-A zeolite

(2011) A. Zukal et al.   MICROPOROUS AND MESOPOROUS MATERIALS

Probing the surfaces of heterogeneous catalysts by in situ IR spectroscopy

(2010) Carlo Lamberti et al.   CHEMICAL SOCIETY REVIEWS

Cooperative Cation Migrations upon CO Addition in CuI- and Alkali-Exchanged Faujasite: A DFT Study

(2010) Zalfa Nour et al.   Journal of Physical Chemistry C

Study of adsorption sites heterogeneity in zeolites by means of coupled microcalorimetry with volumetry

(2010) Roman Bulánek et al.   JOURNAL OF THERMAL ANALYSIS AND CALORIMETRY

Existence of dual species composed of Cu+ in CuMFI being bridged by C2H2

(2010) Atsushi Itadani et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Experimental and theoretical determination of adsorption heats of CO2 over alkali metal exchanged ferrierites with different Si/Al ratio

(2010) Arnošt Zukal et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Evidencing the three cationic coordination vacancies of SII Na+ in NaY zeolite: additional insights from IR surface species

(2010) Olivier Cairon   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

The role of the extra-framework cations in the adsorption of CO2 on faujasite Y

(2010) G. D. Pirngruber et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Microcalorimetric and FTIR Study of the Adsorption of Carbon Dioxide on Alkali-Metal Exchanged FER Zeolites

(2010) Roman Bulánek et al.   TOPICS IN CATALYSIS

Adsorption of Carbon Dioxide on High-Silica Zeolites with Different Framework Topology

(2010) Arnošt Zukal et al.   TOPICS IN CATALYSIS

Hydrogen adsorption on the faujasite-type zeolite Mg–X: An IR spectroscopic and thermodynamic study

(2009) G. Turnes Palomino et al.   APPLIED SURFACE SCIENCE

Characterization of zeolite basicity using probe molecules by means of infrared and solid state NMR spectroscopies

(2009) Manuel Sánchez-Sánchez et al.   CATALYSIS TODAY

Hydrogen adsorption on the zeolite Ca-A: DFT and FT-IR investigation

(2009) C. Otero Areán et al.   CHEMICAL PHYSICS LETTERS

Computational and Variable-Temperature Infrared Spectroscopic Studies on Carbon Monoxide Adsorption on Zeolite Ca-A

(2009) Angeles Pulido et al.   CHEMPHYSCHEM

Carbon dioxide (C16O2 and C18O2) adsorption in zeolite Y materials: effect of cation, adsorbed water and particle size

(2009) Pragati Galhotra et al.   Energy & Environmental Science

Thermodynamics of hydrogen adsorption on calcium-exchanged faujasite-type zeolites

(2009) G.T. Palomino et al.   INTERNATIONAL JOURNAL OF HYDROGEN ENERGY

New insights on zeolite chemistry by advanced IR and NMR characterization tools

(2009) Jean-Pierre Gilson et al.   JOURNAL OF MOLECULAR CATALYSIS A-CHEMICAL

Localization and Coordination of Mg2+ Cations in Ferrierite: Combined FTIR Spectroscopic and Computation Investigation of CO Adsorption Complexes

(2009) R. Bulánek et al.   Journal of Physical Chemistry C

Adsorption of CO2 on Sodium-Exchanged Ferrierites: The Bridged CO2 Complexes Formed between Two Extraframework Cations

(2009) Angeles Pulido et al.   Journal of Physical Chemistry C

New Insights on CO2−Methane Separation Using LTA Zeolites with Different Si/Al Ratios and a First Comparison with MOFs

(2009) Miguel Palomino et al.   LANGMUIR

State-of-the-art Adsorption and Membrane Separation Processes for Carbon Dioxide Production from Carbon Dioxide Emitting Industries

(2009) Armin D. Ebner et al.   SEPARATION SCIENCE AND TECHNOLOGY

Thermodynamics of hydrogen adsorption on the zeolite Ca-Y

(2008) G. Turnes Palomino et al.   CATALYSIS TODAY

Investigation of the benzene-dimer potential energy surface: DFT/CCSD(T) correction scheme

(2008) Ota Bludský et al.   JOURNAL OF CHEMICAL PHYSICS

Location of Mg Cations in Mordenite Zeolite Studied by IR Spectroscopy and Density Functional Theory Simulations with a CO Adsorption Probe

(2008) Keju Sun et al.   JOURNAL OF PHYSICAL CHEMISTRY A

On the Use of CHClF2 as a Probe of Basic Sites in Zeolites: The Host−Guest Interactions Investigated by Multinuclear NMR

(2008) Manuel Sánchez-Sánchez et al.   Journal of Physical Chemistry C

Computational and Fourier Transform Infrared Spectroscopic Studies on Carbon Monoxide Adsorption on the Zeolites Na-ZSM-5 and K-ZSM-5:  Evidence of Dual-Cation Sites

(2008) C. Otero Areán et al.   Journal of Physical Chemistry C

Extraframework cation distributions in X and Y faujasite zeolites: A review

(2008) T. Frising et al.   MICROPOROUS AND MESOPOROUS MATERIALS

Interaction of acetonitrile with Na-zeolites: adsorption modes and vibrational dynamics in the zeolite channels and cavities

(2008) Dana Nachtigallová et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

B3LYP augmented with an empirical dispersion term (B3LYP-D*) as applied to molecular crystals

(2007) Bartolomeo Civalleri et al.   CRYSTENGCOMM

A review of the computational studies of proton- and metal-exchanged chabazites as media for molecular hydrogen storage performed with the CRYSTAL code

(2007) F TORRES   INTERNATIONAL JOURNAL OF HYDROGEN ENERGY

Alkali and alkaline-earth cation exchanged chabazite zeolites for adsorption based CO2 capture

(2007) Jun Zhang et al.   MICROPOROUS AND MESOPOROUS MATERIALS