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

Lin, Wang-Qiang; Xiong, Xue-Lian; Liang, Heng; Chen, Guang-Hui

Lin, Wang-Qiang; Xiong, Xue-Lian; Liang, Heng; Chen, Guang-Hui.

Afiliação

Lin WQ; Department of Chemistry and Key Laboratory for Preparation and Application of Ordered Structural Materials of Guangdong Province, Shantou University, Shantou, Guangdong 515063, China.
Xiong XL; Department of Chemistry and Key Laboratory for Preparation and Application of Ordered Structural Materials of Guangdong Province, Shantou University, Shantou, Guangdong 515063, China.
Liang H; Department of Chemistry and Key Laboratory for Preparation and Application of Ordered Structural Materials of Guangdong Province, Shantou University, Shantou, Guangdong 515063, China.
Chen GH; Department of Chemistry and Key Laboratory for Preparation and Application of Ordered Structural Materials of Guangdong Province, Shantou University, Shantou, Guangdong 515063, China.

ACS Appl Mater Interfaces ; 13(15): 17998-18009, 2021 Apr 21.

Article em En | MEDLINE | ID: mdl-33821608

Palavras-chave

CoRE-MOF database; Kr/Xe separation; MOFs; multiscale computational screening; structure−property relationship

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Texto completo: 1 Base de dados: MEDLINE Tipo de estudo: Diagnostic_studies / Screening_studies Idioma: En Revista: ACS Appl Mater Interfaces Assunto da revista: BIOTECNOLOGIA / ENGENHARIA BIOMEDICA Ano de publicação: 2021 Tipo de documento: Article País de afiliação: China

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