Effect of Diffusion Constraints and ZnOx Speciation on Nonoxidative Dehydrogenation of Propane and Isobutane over ZnO-Containing Catalysts

In situ imaging of the sorption-induced subcell topological flexibility of a rigid zeolite framework

(2022) Hao Xiong et al.   SCIENCE

Controlling Reaction-Induced Loss of Active Sites in ZnOx/Silicalite-1 for Durable Nonoxidative Propane Dehydrogenation

(2022) Dan Zhao et al.   ACS Catalysis

Propane Dehydrogenation on Ga2O3-Based Catalysts: Contrasting Performance with Coordination Environment and Acidity of Surface Sites

(2021) Pedro Castro-Fernández et al.   ACS Catalysis

Effect of External Surface Diffusion Barriers on Platinum/Beta‐Catalyzed Isomerization of n ‐Pentane

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

Regulating coordination number in atomically dispersed Pt species on defect-rich graphene for n-butane dehydrogenation reaction

(2021) Xiaowen Chen et al.   Nature Communications

Propane dehydrogenation catalyzed by in-situ partially reduced zinc cations confined in zeolites

(2021) Linjun Xie et al.   Journal of Energy Chemistry

Doubly Decorated Platinum–Gallium Intermetallics as Stable Catalysts for Propane Dehydrogenation

(2021) Yuki Nakaya et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Silicalite‐1 Supported ZnO as an Efficient Catalyst for Direct Propane Dehydrogenation

(2021) Jie Liu et al.   ChemCatChem

Supported Cu II Single‐Ion Catalyst for Total Carbon Utilization of C 2 and C 3 Biomass‐Based Platform Molecules in the N‐Formylation of Amines

(2021) Xingchao Dai et al.   CHEMISTRY-A EUROPEAN JOURNAL

Stable and selective catalysts for propane dehydrogenation operating at thermodynamic limit

(2021) Ali Hussain Motagamwala et al.   SCIENCE

Propane Dehydrogenation Catalyzed by Isolated Pt Atoms in ≡SiOZn–OH Nests in Dealuminated Zeolite Beta

(2021) Liang Qi et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

In situ formation of ZnOx species for efficient propane dehydrogenation

(2021) Dan Zhao et al.   NATURE

Ultrasmall Co confined in the silanols of dealuminated beta zeolite: A highly active and selective catalyst for direct dehydrogenation of propane to propylene

(2020) Chong Chen et al.   JOURNAL OF CATALYSIS

Dependence of zeolite topology on alkane diffusion inside diverse channels

(2020) Zhiqiang Liu et al.   AICHE JOURNAL

Light Olefin Diffusion during the MTO Process on H-SAPO-34: A Complex Interplay of Molecular Factors

(2020) Pieter Cnudde et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Imaging spatiotemporal evolution of molecules and active sites in zeolite catalyst during methanol-to-olefins reaction

(2020) Mingbin Gao et al.   Nature Communications

Simultaneous Evaluation of Reaction and Diffusion over Molecular Sieves for Shape-Selective Catalysis

(2020) Jingfeng Han et al.   ACS Catalysis

Elucidating the Nature of Active Sites and Fundamentals for their Creation in Zn-Containing ZrO2–Based Catalysts for Nonoxidative Propane Dehydrogenation

(2020) Shanlei Han et al.   ACS Catalysis

Effects of Framework Flexibility on the Adsorption and Diffusion of Aromatics in MFI-Type Zeolites

(2020) Sebastián Caro-Ortiz et al.   Journal of Physical Chemistry C

Coking-Resistant Iron Catalyst in Ethane Dehydrogenation Achieved through Siliceous Zeolite Modulation

(2020) Zhiyuan Yang et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Core‐shell structured HZSM ‐5@ mesoSiO 2 catalysts with tunable shell thickness for efficient n ‐butane catalytic cracking

(2020) Qingxin Yang et al.   AICHE JOURNAL

Hydroxyl-Mediated Non-oxidative Propane Dehydrogenation over VO x /γ-Al2 O3 Catalysts with Improved Stability

(2018) Zhi-Jian Zhao et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Silicalite-1 zeolite acidification by zinc modification and its catalytic properties for isobutane conversion

(2018) Guodong Liu et al.   RSC Advances

Control of coordinatively unsaturated Zr sites in ZrO2 for efficient C–H bond activation

(2018) Yaoyuan Zhang et al.   Nature Communications

ZnO Nanoclusters Supported on Dealuminated Zeolite β as a Novel Catalyst for Direct Dehydrogenation of Propane to Propylene

(2018) Chong Chen et al.   ChemCatChem

Influence of the kind of VO x structures in VO x /MCM-41 on activity, selectivity and stability in dehydrogenation of propane and isobutane

(2017) Uwe Rodemerck et al.   JOURNAL OF CATALYSIS

ZnO modified ZSM-5 and Y zeolites fabricated by atomic layer deposition for propane conversion

(2016) Ting Gong et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Platinum-Modified ZnO/Al2O3 for Propane Dehydrogenation: Minimized Platinum Usage and Improved Catalytic Stability

(2016) Gang Liu et al.   ACS Catalysis

ZrO2-Based Alternatives to Conventional Propane Dehydrogenation Catalysts: Active Sites, Design, and Performance

(2015) Tatyana Otroshchenko et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Isolated FeII on Silica As a Selective Propane Dehydrogenation Catalyst

(2015) Bo Hu et al.   ACS Catalysis

Metal-doped Zeolites as Green Catalysts for Organic Synthesis

(2015) Stefan Chassaing et al.   ZEITSCHRIFT FUR NATURFORSCHUNG SECTION B-A JOURNAL OF CHEMICAL SCIENCES

Propylene Hydrogenation and Propane Dehydrogenation by a Single-Site Zn2+ on Silica Catalyst

(2014) Neil M. Schweitzer et al.   ACS Catalysis

Regeneration of a Commercial Catalyst for the Dehydrogenation of Isobutane to Isobutene

(2013) S. K. Masoudian et al.   CHEMICAL ENGINEERING & TECHNOLOGY

cp2k: atomistic simulations of condensed matter systems

(2013) Jürg Hutter et al.   Wiley Interdisciplinary Reviews-Computational Molecular Science

Effect of the damping function in dispersion corrected density functional theory

(2011) Stefan Grimme et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Structure and Reactivity of Zn-Modified ZSM-5 Zeolites: The Importance of Clustered Cationic Zn Complexes

(2011) Sami M. T. Almutairi et al.   ACS Catalysis

Tests of the RPBE, revPBE, τ-HCTHhyb, ωB97X-D, and MOHLYP density functional approximations and 29 others against representative databases for diverse bond energies and barrier heights in catalysis

(2010) Ke Yang et al.   JOURNAL OF CHEMICAL PHYSICS

A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu

(2010) Stefan Grimme et al.   JOURNAL OF CHEMICAL PHYSICS