Understanding the influence of secondary building units on the thermal conductivity of metal–organic frameworks <i>via</i> high-throughput computational screening-Reference-Cited by-同舟云学术

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Understanding the influence of secondary building units on the thermal conductivity of metal–organic frameworks via high-throughput computational screening

Published:2023 Issue:47 Volume:25 Page:32407-32415
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Lin Yuanchuang¹,Cheng Ruihuan²,Liang Tiangui¹,Wu Weixiong¹,Li Song³^ORCID,Li Wei¹^ORCID

Affiliation:

1. Energy & Electricity Research Center, Jinan University, Zhuhai, 519070, China

2. Department of Mechanical Engineering, The University of HongKong, Pokfulam Road, HongKong SAR 999077, China

3. Department of New Energy Science and Engineering, School of Energy and Power Engineering, Huazhong University of Science and Technology, Wuhan 430074, China

Abstract

The pathway factor was proposed to generally quantify the influence of different secondary building units on the thermal conductivity of metal–organic frameworks.

Funder

National Natural Science Foundation of China

China Postdoctoral Science Foundation

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2023/CP/D3CP04640K

Reference54 articles.

1. Functional Porous Coordination Polymers

2. Metal–organic frameworks: a new class of porous materials

3. Machine Learning Meets with Metal Organic Frameworks for Gas Storage and Separation

4. Metal–Organic Frameworks for Separation

5. Competitive Coadsorption of CO2with H2O, NH3, SO2, NO, NO2, N2, O2, and CH4in M-MOF-74 (M = Mg, Co, Ni): The Role of Hydrogen Bonding

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