Computational development of the nanoporous materials genome
نویسندگان
چکیده
منابع مشابه
Computational Chemistry Methods for Nanoporous Materials
We present here the computational chemistry methods our group uses to investigate the physical and chemical properties of nanoporous materials and adsorbed fluids. We highlight the multiple time and length scales at which these properties can be examined and discuss the computational tools relevant to each scale. Furthermore, we include the key points to considerupsides, downsides, and possibl...
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ژورنال
عنوان ژورنال: Nature Reviews Materials
سال: 2017
ISSN: 2058-8437
DOI: 10.1038/natrevmats.2017.37