Emily A Carter

69PUBLICATIONS
130CO-AUTHORS
Metal organic frameworksElemental semiconductorsComputational chemistryCatalysis and mechanisms of reactionsSolid state chemistry
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Publications (69)

|Jul 09, 2026
Metal-bicarbonate ion pairing in alkaline aqueous solutions from multilevel embedded correlated wavefunction theory and molecular dynamics.

|Jun 02, 2026
Correction to "Combining Density Functional Embedding Theory and DMRG-NEVPT2 to Treat Large Active Spaces: Addressing Electronic Structure Complexity in Single-Atom Alloys".

|May 07, 2026
Transfer Learning Meets Embedded Correlated Wavefunction Theory for Chemically Accurate Molecular Simulations: Application to Calcium Carbonate Ion Pairing.

|Mar 18, 2026
Insights into Nonelectroactive C-C Bond Formation on Cu(100) during Electrochemical CO<sub>2</sub> Reduction from Multiconfigurational Wavefunction Theory.

John Mark P Martirez, Emily A Carter

|Feb 19, 2026
Combining Density Functional Embedding Theory and DMRG-NEVPT2 to Treat Large Active Spaces: Addressing Electronic Structure Complexity in Single-Atom Alloys.

Phillips Hutchison, Ziyang Wei, Emily A Carter

|Feb 12, 2026
C-C Bond Formation during Electrochemical CO<sub>2</sub> Reduction on Pristine Cu(100) Unlikely to Involve Adsorbed CO at Any Potential.

John Mark P Martirez, Emily A Carter

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Frequent Collaborators

20 joint publications

John Mark P Martirez

7 joint publications

Peter Nordlander

6 joint publications

Naomi J Halas

6 joint publications

Hossein Robatjazi