Emily A. Carter

Research.com Recognitions

• 2025 - Research.com Best Female Scientists Award
• 2020 - Member of the European Academy of Sciences
• 2016 - Member of the National Academy of Engineering For development of quantum chemistry computational methods for the design of molecules and materials for sustainable energy.
• 2014 - Fellow, National Academy of Inventors
• 2008 - Fellow of the American Academy of Arts and Sciences
• 2008 - Member of the National Academy of Sciences
• 1999 - Fellow of the American Association for the Advancement of Science (AAAS)
• 1998 - Fellow of American Physical Society (APS) Citation For her pioneering development and applications of abinitio methods to energetics, kinetics and dynamics studies of surface reactions
• 1993 - Fellow of Alfred P. Sloan Foundation

Overview

Best Publications

• The technological and economic prospects for CO2 utilization and removal

  Cameron Hepburn;Ella Adlen;John Beddington;Emily A. Carter;Emily A. Carter

  2176
  Citations

• Hot Electrons Do the Impossible: Plasmon-Induced Dissociation of H2 on Au

  Shaunak Mukherjee;Florian Libisch;Nicolas Large;Oara Neumann

  1721
  Citations

• Constrained reaction coordinate dynamics for the simulation of rare events

  E.A. Carter;Giovanni Ciccotti;Giovanni Ciccotti;James T. Hynes;Raymond Kapral

  1186
  Citations

• Quantifying hot carrier and thermal contributions in plasmonic photocatalysis

  Linan Zhou;Dayne F. Swearer;Chao Zhang;Hossein Robatjazi

  1058
  Citations

• Oligoacenes: Theoretical Prediction of Open-Shell Singlet Diradical Ground States

  Michael Bendikov;Hieu M. Duong;Kyle Starkey;K. N. Houk

  801
  Citations

• Light-driven methane dry reforming with single atomic site antenna-reactor plasmonic photocatalysts

  Linan Zhou;John Mark P. Martirez;John Mark P. Martirez;Jordan Finzel;Chao Zhang

  711
  Citations

• Diffusion of interstitial hydrogen into and through bcc Fe from first principles

  D. E. Jiang;Emily A. Carter

  638
  Citations

• Water Oxidation on Pure and Doped Hematite (0001) Surfaces: Prediction of Co and Ni as Effective Dopants for Electrocatalysis

  Peilin Liao;John A. Keith;Emily A. Carter

  598
  Citations

• Theoretical Insights into Heterogeneous (Photo)electrochemical CO2 Reduction

  Shenzhen Xu;Emily Ann Carter

  598
  Citations

• Carbon dissolution and diffusion in ferrite and austenite from first principles

  D. E. Jiang;Emily A. Carter

  565
  Citations

• Heterometallic antenna-reactor complexes for photocatalysis

  Dayne F. Swearer;Hangqi Zhao;Linan Zhou;Chao Zhang

  539
  Citations

• First principles scheme to evaluate band edge positions in potential transition metal oxide photocatalysts and photoelectrodes

  Maytal Caspary Toroker;Dalal K. Kanan;Nima Alidoust;Leah Y. Isseroff

  500
  Citations

• Solvation dynamics for an ion pair in a polar solvent: Time‐dependent fluorescence and photochemical charge transfer

  Emily A. Carter;James T. Hynes

  498
  Citations

• First principles study of the surfaces of Zirconia

  Asbjørn Christensen;Emily A. Carter

  497
  Citations

• A quantum-mechanically informed continuum model of hydrogen embrittlement

  S. Serebrinsky;E. A. Carter;M. Ortiz

  404
  Citations

• Aluminum Nanocrystals as a Plasmonic Photocatalyst for Hydrogen Dissociation

  Linan Zhou;Chao Zhang;Michael J. McClain;Alejandro Manjavacas

  385
  Citations

• Rotationally invariant ab initio evaluation of Coulomb and exchange parameters for DFT+U calculations

  Nicholas J. Mosey;Peilin Liao;Emily A. Carter

  381
  Citations

• Relation between singlet-triplet gaps and bond energies

  Emily A. Carter;William A. Goddard

  362
  Citations

• Mechanistic Contrasts between Manganese and Rhenium Bipyridine Electrocatalysts for the Reduction of Carbon Dioxide

  Christoph Riplinger;Matthew D. Sampson;Andrew M. Ritzmann;Clifford P. Kubiak

  358
  Citations

• Orbital-free kinetic-energy density functionals with a density-dependent kernel

  Yan Alexander Wang;Niranjan Govind;Emily A. Carter

  341
  Citations