Building a Consistent and Reproducible Database for Adsorption Evaluation in Covalent–Organic Frameworks

[Image: see text] We present a workflow that traces the path from the bulk structure of a crystalline material to assessing its performance in carbon capture from coal’s postcombustion flue gases. This workflow is applied to a database of 324 covalent–organic frameworks (COFs) reported in the litera...

Descripción completa

Detalles Bibliográficos
Autores principales: Ongari, Daniele, Yakutovich, Aliaksandr V., Talirz, Leopold, Smit, Berend
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2019
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6822289/
https://www.ncbi.nlm.nih.gov/pubmed/31681834
http://dx.doi.org/10.1021/acscentsci.9b00619

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6822289/
https://www.ncbi.nlm.nih.gov/pubmed/31681834
http://dx.doi.org/10.1021/acscentsci.9b00619

Ejemplares similares