Open AccessModeling Metal Influence on the Gate Opening in ZIF-8 Materials
Author(s) -
Jenny G. Vitillo,
Laura Gagliardi
Publication year - 2021
Publication title -
chemistry of materials
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 3.741
H-Index - 375
eISSN - 1520-5002
pISSN - 0897-4756
DOI - 10.1021/acs.chemmater.1c00623
Subject(s) - zeolitic imidazolate framework , imidazolate , antiferromagnetism , density functional theory , phase (matter) , transition metal , band gap , electronic structure , metal , materials science , ambient pressure , linker , chemical physics , photocatalysis , chemistry , catalysis , metal organic framework , nanotechnology , computational chemistry , inorganic chemistry , adsorption , condensed matter physics , optoelectronics , thermodynamics , metallurgy , organic chemistry , computer science , physics , operating system
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