Bo Long

University of Minnesota

Projects

A Joint Experimental and Theoretical Study of the Bonding, Energetics, and Excited States of Uranyl Compounds

Lead Institution

Pacific Northwest National Laboratory

Principal Investigator

Zheming Wang

Project type

Large-Scale EMSL Research

One of the challenges in experimental investigations of actinide complexes is to determine their structures, bonding, and stabilities in solids and solutions. Our recent TRLIF work on U(VI), the…

MN15 and GAM+U: New Kohn-Sham Density Functionals with Broad
Accuracy for Multi-Reference and Single-Reference Systems, Noncovalent
Interactions, and Solid-state Properties

Lead Institution

University of Minnesota

Principal Investigator

Donald Truhlar

Kohn-Sham density functional theory is widely used; however, no currently available exchange-correlation functional can predict all chemical properties with chemical accuracy. We plan to develop new…

Projects

A Joint Experimental and Theoretical Study of the Bonding, Energetics, and Excited States of Uranyl Compounds

MN15 and GAM+U: New Kohn-Sham Density Functionals with Broad Accuracy for Multi-Reference and Single-Reference Systems, Noncovalent Interactions, and Solid-state Properties

MN15 and GAM+U: New Kohn-Sham Density Functionals with Broad
Accuracy for Multi-Reference and Single-Reference Systems, Noncovalent
Interactions, and Solid-state Properties