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The Journal of Chemical Physics|September 13, 2006
Self-consistent embedding theory for locally correlated configuration interaction wave functions in condensed matterPatrick Huang, Emily A CarterChemical Reviews|December 19, 2018
Theoretical Insights into Heterogeneous (Photo)electrochemical CO2 ReductionShenzhen Xu, Emily A CarterNano Letters|June 15, 2006
Local electronic structure around a single Kondo impurityPatrick Huang, Emily A CarterJournal of the American Chemical Society|June 15, 2018
2-Pyridinide as an Active Catalytic Intermediate for CO2 Reduction on p-GaP Photoelectrodes: Lifetime and SelectivityShenzhen Xu, Emily A CarterThe Journal of Chemical Physics|November 25, 2011
Potential-functional embedding theory for molecules and materialsChen Huang, Emily A CarterThe Journal of Chemical Physics|April 5, 2014
Communication: comparing ab initio methods of obtaining effective U parameters for closed-shell materialsKuang Yu, Emily A CarterJournal of Chemical Theory and Computation|September 15, 2018
Potential Functional Embedding Theory with an Improved Kohn-Sham Inversion AlgorithmQi Ou, Emily A CarterThe Journal of Chemical Physics|May 17, 2014
Enhanced von Weizsäcker Wang-Govind-Carter kinetic energy density functional for semiconductorsIlgyou Shin, Emily A CarterJournal of Chemical Theory and Computation|May 7, 2026
Transfer Learning Meets Embedded Correlated Wavefunction Theory for Chemically Accurate Molecular Simulations: Application to Calcium Carbonate Ion PairingXuezhi Bian, Emily A CarterThe Journal of Physical Chemistry. A|January 27, 2006
Insight into selected reactions in low-temperature dimethyl ether combustion from Born-Oppenheimer molecular dynamicsAmity Andersen, Emily A CarterPageof 21