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Biophysical Journal|December 20, 2015
Flavin Binding to the Deca-heme Cytochrome MtrC: Insights from Computational Molecular SimulationMarian Breuer, Kevin M Rosso, Jochen Blumberger
Proceedings of the National Academy of Sciences of the United States of America|January 4, 2014
Electron flow in multiheme bacterial cytochromes is a balancing act between heme electronic interaction and redox potentialsMarian Breuer, Kevin M Rosso, Jochen Blumberger
Journal of Chemical Theory and Computation|June 14, 2022
Implementation and Validation of Constrained Density Functional Theory Forces in the CP2K PackageChristian S Ahart, Kevin M Rosso, Jochen Blumberger
Physical Chemistry Chemical Physics : PCCP|February 25, 2020
Polaronic structure of excess electrons and holes for a series of bulk iron oxidesChristian S Ahart, Jochen Blumberger, Kevin M Rosso
Journal of the American Chemical Society|March 3, 2022
Electron and Hole Mobilities in Bulk Hematite from Spin-Constrained Density Functional TheoryChristian S Ahart, Kevin M Rosso, Jochen Blumberger
ACS Earth & Space Chemistry|October 25, 2023
Tracking Initial Fe(II)-Driven Ferrihydrite Transformations: A Mössbauer Spectroscopy and Isotope InvestigationDrew Latta, Kevin M Rosso, Michelle M Scherer
The Journal of Chemical Physics|July 20, 2011
A generalized mathematical framework for thermal oxidation kineticsZhijie Xu, Kevin M Rosso, Stephen M Bruemmer
Journal of Chemical Theory and Computation|November 18, 2015
Proton Dynamics on Goethite Nanoparticles and Coupling to Electron TransportPiotr Zarzycki, Dayle M Smith, Kevin M Rosso
Communications Chemistry|January 25, 2023
Ab initio thermodynamics reveals the nanocomposite structure of ferrihydriteMichel Sassi, Anne M Chaka, Kevin M Rosso
Journal of Colloid and Interface Science|November 12, 2016
Probing size-dependent electrokinetics of hematite aggregatesKarolina Kedra-Królik, Kevin M Rosso, Piotr Zarzycki
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