The resulting materials could be used for capturing greenhouse gases.
that they classify as “ultrastable.” These states make them good candidates for applications such as converting methane gas to methanol., they don’t necessarily know beforehand how stable that material is,” said in a statement published on Tuesday Heather Kulik, an MIT associate professor of chemistry and chemical engineering and the senior author of the study.
“Because there are so many different types of LEGO blocks and ways you can assemble them, it gives rise to a combinatorial explosion of different possible metal-organic framework materials,” Kulik said. Today, the most common way to design MOFs is through trial and error. Computational approaches offer a new and better approach to engineering these materials, especially if they take into account the stability of the resulting material.“A really good MOF material for catalysis or for gas storage would have a very open structure, but once you have this open structure, it may be really hard to make sure that that material is also stable under long-term use,” Kulik said.
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