HeydenLab

Mechanistic Insights into Light Alkane Dehydrogenation over Coordinatively Unsaturated Zr Sites on Zirconia | ACS Catalysis pubs.acs.org/doi/pdf/10.102…

Hydrogen Adsorption over Transition Metals in Water | The Journal of Physical Chemistry C pubs.acs.org/doi/10.1021/ac…

Impact of microkinetic modeling assumptions on predicted kinetics and mechanisms over undercoordinated sites. Just published in npj comput mater rdcu.be/eTGEY

Congrats to the team! Beautiful mathematical proofs and AD implementation for DKRCs. Degrees of rate control and AutoDiff-driven direct sensitivity analysi... sciencedirect.com/science/articl…

Nice collaboration with the Medlin group: Investigating the Kinetics of Methyl Acetate Hydrogenolysis over Copper: A Combined Experimental and Computational Study | The Journal of Physical Chemistry C pubs.acs.org/doi/full/10.10…

RT @NobelPrize: Through the development of metal–organic frameworks, 2025 chemistry laureates Susumu Kitagawa, Richard Robson and Omar Yagh…

RT @NobelPrize: BREAKING NEWS The Royal Swedish Academy of Sciences has decided to award the 2025 #NobelPrize in Physics to John Clarke, Mi…

2 new, open TT faculty positions at the University of South Carolina in the Department of Chemical Engineering - open rank. Area of high interest: advanced batteries: uscjobs.sc.edu/postings/188088 and separations: uscjobs.sc.edu/postings/191233

RT @Andrew_S_Rosen: Beyond-DFT results without breaking the bank. 😎 nature.com/articles/s4155…

RT @linicsu: New paper in @ACSCatalysis on the Use of Large Language Models for Extracting and Analyzing Data from Heterogeneous Catalysis…

Understanding the Effect of Platinum Particle Size on Ethane Dehydrogenation and Hydrogenolysis: Particle-Based Microkinetic Modeling at Finite Conversion | ACS Catalysis pubs.acs.org/doi/full/10.10…

Nice collaboration between the Pagan-Torres, Chen, and Heyden groups: Reactor Evaluation and Active Site Identification of Molybdenum Carbid... sciencedirect.com/science/articl…

RT @skundu_07: Adsorption model inside porous media (Zeolite) in presence of liquid. Another one from @HeydenLab. pubs.acs.org/doi/full/10.10…

@marcporosoff I don’t think I have in the last 15 years. Not a big believer in their review process. I know it is getting more common to suggest reviewers on a proposal but I don’t think it is a good idea for science.

I highly recommend the book NEXUS from Harari published by Random House global.penguinrandomhouse.com/announcements/…

Shout out to Zeeshan and his team for organizing our groups exhibit at this year’s E-week. Thank you!

The state of the chemicals industry: Time for bold action and innovation mck.co/3ZXlTFA via @McKinsey

RT @strnr: "As strongly requested by the reviewers, here we cite some references [[35], [36], [37], [38], [39], [40], [41], [42], [43], [44…

RT @OpenCatalyst: Introducing Meta’s Open Materials 2024 (OMat24) Dataset and Models! All under permissive open licenses for commercial and…