Related references
Note: Only part of the references are listed.Highly stable seed-derived ferrierite for carbonylation of dimethyl ether to methyl acetate: Effects of seed content to catalytic stability
Hyun Seung Jung et al.
CATALYSIS TODAY (2020)
Zeolite Adsorption Isotherms Predicted by Pore Channel and Local Environmental Descriptors: Feature Learning on DFT Binding Strength
Yuming Gu et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2020)
Gas-Phase Carbonylation of Dimethyl Ether on the Stable Seed-Derived Ferrierite
Hyungwon Ham et al.
ACS CATALYSIS (2020)
Control of framework Al distribution in ZSM-5 zeolite via post-synthetic TiCl4 treatment
Satoshi Inagaki et al.
MICROPOROUS AND MESOPOROUS MATERIALS (2020)
Regulation of framework Al distribution of high-silica hierarchically structured ZSM-5 zeolites by boron-modification and its effect on materials catalytic performance in methanol-to-propylene reaction
Nan Cui et al.
MICROPOROUS AND MESOPOROUS MATERIALS (2020)
Differentiable Optimization for the Prediction of Ground State Structures (DOGSS)
Junwoong Yoon et al.
PHYSICAL REVIEW LETTERS (2020)
Template-induced Al distribution in MOR and enhanced activity in dimethyl ether carbonylation
Ying Li et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2020)
Control of Hierarchical Structure and Framework-Al Distribution of ZSM-5 via Adjusting Crystallization Temperature and Their Effects on Methanol Conversion
Sungtak Kim et al.
ACS CATALYSIS (2019)
Cooperative Role of Water Molecules during the Initial Stage of Water-Induced Zeolite Dealumination
Katarina Stanciakova et al.
ACS CATALYSIS (2019)
On the Accuracy of Density Functional Theory in Zeolite Catalysis
Tiago J. Goncalves et al.
CHEMCATCHEM (2019)
DFT Study on the Effect of Aluminum Position in Zn-Exchanged MFI on Methane Activation
Sandra C. Albarracin-Suazo et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2019)
Convolutional Neural Network of Atomic Surface Structures To Predict Binding Energies for High-Throughput Screening of Catalysts
Seoin Back et al.
JOURNAL OF PHYSICAL CHEMISTRY LETTERS (2019)
A new kind of atlas of zeolite building blocks
Benjamin A. Helfrecht et al.
JOURNAL OF CHEMICAL PHYSICS (2019)
What Is Measured When Measuring Acidity in Zeolites with Probe Molecules?
Mercedes Boronat et al.
ACS CATALYSIS (2019)
Consequences of exchange-site heterogeneity and dynamics on the UV-visible spectrum of Cu-exchanged SSZ-13
Hui Li et al.
CHEMICAL SCIENCE (2019)
Determining the structures, acidity and adsorption properties of Al substituted HZSM-5
Nan Zhang et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2019)
Collective action of water molecules in zeolite dealumination
Malte Nielsen et al.
CATALYSIS SCIENCE & TECHNOLOGY (2019)
Consideration of the Aluminum Distribution in Zeolites in Theoretical and Experimental Catalysis Research
Brandon C. Knott et al.
ACS CATALYSIS (2018)
Acidic and catalytic properties of ZSM-5 zeolites with different Al distributions
Sungsik Park et al.
CATALYSIS TODAY (2018)
Crystal Graph Convolutional Neural Networks for an Accurate and Interpretable Prediction of Material Properties
Tian Xie et al.
PHYSICAL REVIEW LETTERS (2018)
Tuning Bronsted Acid Strength by Altering Site Proximity in CHA Framework Zeolites
Steven Nystrom et al.
ACS CATALYSIS (2018)
Introducing Catalytic Diversity into Single-Site Chabazite Zeolites of Fixed Composition via Synthetic Control of Active Site Proximity
John R. Di Iorio et al.
ACS CATALYSIS (2017)
The Distribution and Strength of Bronsted Acid Sites on the Multi-Aluminum Model of FER Zeolite: A Theoretical Study
Miao He et al.
CATALYSTS (2017)
A Universal 3D Voxel Descriptor for Solid-State Material Informatics with Deep Convolutional Neural Networks
Seiji Kajita et al.
SCIENTIFIC REPORTS (2017)
Predicting the Mechanical Properties of Zeolite Frameworks by Machine Learning
Jack D. Evans et al.
CHEMISTRY OF MATERIALS (2017)
Energy Analysis of Aluminosilicate Zeolites with Comprehensive Ranges of Framework Topologies, Chemical Compositions, and Aluminum Distributions
Koki Muraoka et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2016)
Comparing molecules and solids across structural and alchemical space
Sandip De et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2016)
The Strength of Bronsted Acid Sites in Microporous Aluminosilicates
Andrew J. Jones et al.
ACS CATALYSIS (2015)
A density functional theory study on ethylene formation and conversion over P modified ZSM-5
Yanping Huang et al.
CATALYSIS SCIENCE & TECHNOLOGY (2015)
Fast Prediction of Adsorption Properties for Platinum Nanocatalysts with Generalized Coordination Numbers
Federico Calle-Vallejo et al.
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2014)
Reactivity Descriptor in Solid Acid Catalysis: Predicting Turnover Frequencies for Propene Methylation in Zeotypes
Chuan-Ming Wang et al.
JOURNAL OF PHYSICAL CHEMISTRY LETTERS (2014)
Effect of the Al Siting on the Structure of Co(II) and Cu(II) Cationic Sites in Ferrierite. A Periodic DFT Molecular Dynamics and FTIR Study
Stepan Sklenak et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2013)
Influence of Acid Strength and Confinement Effect on the Ethylene Dimerization Reaction over Solid Acid Catalysts: A Theoretical Calculation Study
Yueying Chu et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2012)
N2O decomposition over Fe-zeolites: Structure of the active sites and the origin of the distinct reactivity of Fe-ferrierite, Fe-ZSM-5, and Fe-beta. A combined periodic DFT and multispectral study
Stepan Sklenak et al.
JOURNAL OF CATALYSIS (2010)
Periodic DFT investigation of the effect of aluminium content on the properties of the acid zeolite H-FER
L. Grajciar et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2010)
Enzyme-like Specificity in Zeolites: A Unique Site Position in Mordenite for Selective Carbonylation of Methanol and Dimethyl Ether with CO
Mercedes Boronat et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2008)
Effect of framework Si/Al ratio and extra-framework aluminum on the catalytic activity of Y zeolite
Bin Xu et al.
APPLIED CATALYSIS A-GENERAL (2007)
Specificity of sites within eight-membered ring zeolite channels for carbonylation of methyls to acetyls
Aditya Bhan et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2007)
Site requirements and elementary steps in dimethyl ether carbonylation catalyzed by acidic zeolites
Patricia Cheung et al.
JOURNAL OF CATALYSIS (2007)
DFT studies on the location and acid strength of Bronsted acid sites in MCM-22 zeolite
DH Zhou et al.
JOURNAL OF MOLECULAR CATALYSIS A-CHEMICAL (2006)
Selective carbonylation of dimethyl ether to methyl acetate catalyzed by acidic zeolites
P Cheung et al.
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2006)
Distribution of aluminum in different periodical building units of MOR and BEA zeolites
TI Korányi et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2005)
Removal of zinc, copper and lead by natural zeolite - a comparison of adsorption isotherms
J Peric et al.
WATER RESEARCH (2004)
On the preferential location of Al and proton siting in zeolites: A computational and infrared study
G Sastre et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2002)
Copper ion-exchanged zeolite catalysts in deNOx reaction
H Yahiro et al.
APPLIED CATALYSIS A-GENERAL (2001)
Ab initio and density functional study of the activation barrier for ethane cracking in cluster models of zeolite H-ZSM-5
SA Zygmunt et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2000)
Share Paper
