Cheng-Wei’s follow-up paper on our ML-ωPBE functional, titled “Accurate Electronic and Optical Properties of Organic Doublet Radicals Using Machine Learned Range-Separated Functionals” was published in The Journal of Physical Chemistry A! More excitingly, we were selected as the Front Cover of …

Cheng-Wei’s second paper about machine learned range separation parameter was selected as the Front Cover by The Journal of Physical Chemistry A! Read more »

Our research article with the group of Jian Zhang, titled “Inserting Single-Atom Zn by Tannic Acid Confinement to Regulate the Selectivity of Pd Nanocatalysts for Hydrogenation Reactions“, is published in Small! Our postdoc Jun is the co-first author of this …

Jun’s co-first-authored paper about hydrogenation reactions was published in Small! Read more »