scholarly journals In Silico Screening of Metal–Organic Frameworks for Adsorption-Driven Heat Pumps and Chillers

2018 ◽  
Vol 10 (32) ◽  
pp. 27074-27087 ◽  
Author(s):  
Máté Erdős ◽  
Martijn F. de Lange ◽  
Freek Kapteijn ◽  
Othonas A. Moultos ◽  
Thijs J. H. Vlugt
Keyword(s):  
In Silico ◽  
Metal Organic Frameworks ◽  
Heat Pumps ◽  
In Silico Screening ◽  
Metal Organic

In silico screening of 4764 computation-ready, experimental metal–organic frameworks for CO2 separation

2016 ◽  
Vol 4 (6) ◽  
pp. 2105-2114 ◽  
Author(s):  
Zhiwei Qiao ◽  
Kang Zhang ◽  
Jianwen Jiang
Keyword(s):  
In Silico ◽  
Metal Organic Frameworks ◽  
Co2 Separation ◽  
In Silico Screening ◽  
Metal Organic

We screened 4764 metal–organic frameworks and identified the best candidates for CO2 separation.

Large-scale evaluation of cascaded adsorption heat pumps based on metal/covalent–organic frameworks

2019 ◽  
Vol 7 (43) ◽  
pp. 25010-25019 ◽  
Author(s):  
Wei Li ◽  
Xiaoxiao Xia ◽  
Song Li
Keyword(s):  
High Throughput ◽  
Large Scale ◽  
Metal Organic Frameworks ◽  
Heat Pumps ◽  
Adsorption Heat ◽  
Covalent Organic Frameworks ◽  
Scale Evaluation ◽  
Computational Screening ◽  
Metal Organic

High-throughput computational screening of millions of cascaded adsorption heat pumps based on metal–organic frameworks and covalent–organic frameworks.

Adsorption-Driven Heat Pumps: The Potential of Metal–Organic Frameworks

2015 ◽  
Vol 115 (22) ◽  
pp. 12205-12250 ◽  
Author(s):  
Martijn F. de Lange ◽  
Karlijn J. F. M. Verouden ◽  
Thijs J. H. Vlugt ◽  
Jorge Gascon ◽  
Freek Kapteijn
Keyword(s):  
Metal Organic Frameworks ◽  
Heat Pumps ◽  
Metal Organic
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