Abstract:Metal-organic frameworks (MOFs) have great potential for the capture of
volatile iodine. The effect of a precise regulation of active sites in
JLNU-4 (MOFs) on capture of iodine was investigated by Monte Carlo (MC)
method and molecular dynamics (MD), and it was found that the larger the
Zn/Cd atomic ratio, the better the iodine capture. Interestingly,
compared with the meta-position regulation of Zn/Cd, the ortho-positions
regulation increased the free volume of the crystal and enhanced the
interaction between… Show more
scite is a Brooklyn-based organization that helps researchers better discover and understand research articles through Smart Citations–citations that display the context of the citation and describe whether the article provides supporting or contrasting evidence. scite is used by students and researchers from around the world and is funded in part by the National Science Foundation and the National Institute on Drug Abuse of the National Institutes of Health.