CTC Highlights

CTC Highlights provide an inside look at Chemical Theory Center publications, showcasing the entire creation process from ideation to the most interesting findings. Each highlight dives into the importance of the research and the contribution it makes to today's society.

Influence of First and Second Coordination Environment on Structural Fe(II) Sites in MIL-101 for C–H Bond Activation in Methane

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March 11, 2021 -- A CTC publication entitled “Influence of First and Second Coordination Environment on Structural Fe(II) Sites in MIL-101 for C–H Bond Activation in Methane” was published on December 28 in ACS Catalysis. CTC alumni Jenny Vitillo and faculty Christopher J. Cramer and Laura Gagliardi are authors of the publication.

Engineering Electrical Conductivity in Stable Zirconium-Based PCN-222 MOFs with Permanent Mesoporosity

Engineering Electrical Conductivity in Stable Zirconium-Based PCN-222 MOFs with Permanent Mesoporosity

September 24, 2020 -- A CTC publication entitled “Engineering Electrical Conductivity in Stable Zirconium-Based PCN-222 MOFs with Permanent Mesoporosity” was published on June 29 in Chemistry of Materials. CTC alumni Saied Md Pratik and faculty Laura Gagliardi and Christopher J. Cramer are authors on the publication.