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The Journal of Chemical Physics|January 7, 2006
Atomic origin of hysteresis during cyclic loading of Si due to bond rearrangements at the crack surfacesRobin L Hayes, Emily A CarterThe Journal of Chemical Physics|March 19, 2008
Nonadiabaticity in the iron bcc to hcp phase transformationDonald F Johnson, Emily A CarterJournal of Chemical Theory and Computation|November 26, 2015
Valence Excited States in Large Molecules via Local Multireference Singles and Doubles Configuration InteractionTsz S Chwee, Emily A CarterThe Journal of Physical Chemistry. B|July 21, 2006
Effects of alloying on the chemistry of CO and H2S on Fe surfacesD E Jiang, Emily A CarterPhysical Chemistry Chemical Physics : PCCP|February 24, 2012
Approximately size extensive local Multireference Singles and Doubles Configuration InteractionDavid B Krisiloff, Emily A CarterAccounts of Chemical Research|September 26, 2017
The Holy Grail: Chemistry Enabling an Economically Viable CO2 Capture, Utilization, and Storage StrategyThomas P Senftle, Emily A CarterACS Nano|March 21, 2018
Mechanistic Insights into Photocatalyzed Hydrogen Desorption from Palladium Surfaces Assisted by Localized Surface Plasmon ResonancesVincent A Spata, Emily A CarterThe Journal of Physical Chemistry. B|November 3, 2006
Prediction of a highly activated state of CO adsorbed on an Al/Fe(100) bimetallic surfaceD E Jiang, Emily A CarterThe Journal of Physical Chemistry. B|December 12, 2023
Characterizing the Mechanisms of Ca and Mg Carbonate Ion-Pair Formation with Multi-Level Molecular Dynamics/Quantum Mechanics SimulationsJan-Niklas Boyn, Emily A CarterProceedings of the National Academy of Sciences of the United States of America|May 3, 2005
Finding transition states for crystalline solid-solid phase transformationsKyle J Caspersen, Emily A CarterPageof 20