Multiscale Computational Screening of Metal–Organic Frameworks for Kr/Xe Adsorption Separation: A Structure–Property Relationship-Based Screening Strategy

2021 ◽  
Author(s):  
Wang-qiang Lin ◽  
Xue-lian Xiong ◽  
Heng Liang ◽  
Guang-hui Chen
Keyword(s):  
Metal Organic Frameworks ◽  
Screening Strategy ◽  
Structure Property ◽  
Property Relationship ◽  
Computational Screening ◽  
Structure Property Relationship ◽  
Metal Organic

Carbon capture and conversion using metal–organic frameworks and MOF-based materials

2019 ◽  
Vol 48 (10) ◽  
pp. 2783-2828 ◽  
Author(s):  
Meili Ding ◽  
Robinson W. Flaig ◽  
Hai-Long Jiang ◽  
Omar M. Yaghi
Keyword(s):  
Carbon Dioxide ◽  
Carbon Capture ◽  
Carbon Dioxide Capture ◽  
Metal Organic Framework ◽  
Metal Organic Frameworks ◽  
Structure Property ◽  
Property Relationship ◽  
Recent Advances ◽  
Structure Property Relationship ◽  
Metal Organic

This review summarizes recent advances and highlights the structure–property relationship on metal–organic framework-based materials for carbon dioxide capture and conversion.

Structure–property relationship of metal–organic frameworks for alcohol-based adsorption-driven heat pumps via high-throughput computational screening

2019 ◽  
Vol 7 (13) ◽  
pp. 7470-7479 ◽  
Author(s):  
Wei Li ◽  
Xiaoxiao Xia ◽  
Meng Cao ◽  
Song Li
Keyword(s):  
High Throughput ◽  
Metal Organic Frameworks ◽  
Heat Pumps ◽  
Structure Property ◽  
P Adsorption ◽  
Adsorption Performance ◽  
Computational Screening ◽  
Structure Property Relationship ◽  
Metal Organic ◽  
Relationship Of

Adsorption-driven heat pumps (AHPs) based on metal–organic frameworks (MOFs) have been garnering rapidly growing research interests due to their outstanding adsorption performance.

The Microscopic Structure–Property Relationship of Metal–Organic Polyhedron Nanocomposites

2019 ◽  
Vol 58 (48) ◽  
pp. 17412-17417 ◽  
Author(s):  
Mingxin Zhang ◽  
Yuyan Lai ◽  
Mu Li ◽  
Tao Hong ◽  
Weiyu Wang ◽  
...  
Keyword(s):  
Microscopic Structure ◽  
Structure Property ◽  
Property Relationship ◽  
Structure Property Relationship ◽  
Metal Organic ◽  
Relationship Of

High-throughput computational screening of metal–organic frameworks

2014 ◽  
Vol 43 (16) ◽  
pp. 5735-5749 ◽  
Author(s):  
Yamil J. Colón ◽  
Randall Q. Snurr
Keyword(s):  
High Throughput ◽  
Metal Organic Frameworks ◽  
Structure Property ◽  
Performance Limits ◽  
Structure Property Relationships ◽  
Computational Screening ◽  
Metal Organic ◽  
And Performance

High-throughput computational screening of MOFs allows identification of promising candidates, new structure–property relationships, and performance limits.

scholarly journals Screening of metal–organic frameworks for water adsorption heat transformation using structure–property relationships

RSC Advances ◽  
2020 ◽  
Vol 10 (57) ◽  
pp. 34621-34631
Author(s):  
Min Xu ◽  
Zhangli Liu ◽  
Xiulan Huai ◽  
Lanting Lou ◽  
Jiangfeng Guo
Keyword(s):  
Water Adsorption ◽  
Metal Organic Frameworks ◽  
Quantitative Structure ◽  
Structure Property ◽  
Adsorption Performance ◽  
Structure Property Relationships ◽  
Structure Property Relationship ◽  
Physicochemical Features ◽  
Metal Organic ◽  
Heat Transformation

Quantitative structure–property relationship models that correlate the water adsorption performance of MOFs to their physicochemical features have been established.

scholarly journals Recent progress in metal–organic framework/graphene-derived materials for energy storage and conversion: design, preparation, and application

2021 ◽  
Author(s):  
Kaixi Wang ◽  
Kwun Nam Hui ◽  
Kwan San Hui ◽  
Shaojun Peng ◽  
Yuxi Xu
Keyword(s):  
Energy Storage ◽  
Detailed Analysis ◽  
Recent Progress ◽  
Metal Organic Framework ◽  
Energy Storage And Conversion ◽  
Structure Property ◽  
Property Relationship ◽  
Structure Property Relationship ◽  
Metal Organic ◽  
Organic Framework

This review summarizes comprehensively the latest methods of synthesizing MOFs/graphene and their derivatives, and their application in energy storage and conversion with a detailed analysis of the structure–property relationship.

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