Calculation of Self, Corrected, and Transport Diffusivities of Isopropyl Alcohol in UiO-66.

Mhatre, Chinmay V; Wardzala, Jacob J; Shukla, Priyanka B; Agrawal, Mayank; Johnson, J Karl

Mhatre, Chinmay V; Wardzala, Jacob J; Shukla, Priyanka B; Agrawal, Mayank; Johnson, J Karl.

Afiliación

Mhatre CV; Department of Chemical and Petroleum Engineering, University of Pittsburgh, Pittsburgh, PA 15260, USA.
Wardzala JJ; Department of Chemical and Petroleum Engineering, University of Pittsburgh, Pittsburgh, PA 15260, USA.
Shukla PB; Department of Chemical and Petroleum Engineering, University of Pittsburgh, Pittsburgh, PA 15260, USA.
Agrawal M; TCAD, TSMC Technoloy Inc., San Jose, CA 95051, USA.
Johnson JK; Department of Chemical and Petroleum Engineering, University of Pittsburgh, Pittsburgh, PA 15260, USA.

Nanomaterials (Basel) ; 13(11)2023 Jun 02.

Article en En | MEDLINE | ID: mdl-37299696

Palabras clave

diffusion coefficients; hydrogen bonding; metal organic frameworks; molecular dynamics

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Texto completo: 1 Colección: 01-internacional Base de datos: MEDLINE Idioma: En Revista: Nanomaterials (Basel) Año: 2023 Tipo del documento: Article País de afiliación: Estados Unidos

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