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Journal of the American Chemical Society|January 23, 2019
Microsolvation of the Redox-Active Tyrosine-D in Photosystem II: Correlation of Energetics with EPR Spectroscopy and Oxidation-Induced Proton TransferAbhishek Sirohiwal, Frank Neese, Dimitrios A Pantazis
Annual Review of Biochemistry|March 27, 2020
Current Understanding of the Mechanism of Water Oxidation in Photosystem II and Its Relation to XFEL DataNicholas Cox, Dimitrios A Pantazis, Wolfgang Lubitz
Journal of the American Chemical Society|October 9, 2020
Protein Matrix Control of Reaction Center Excitation in Photosystem IIAbhishek Sirohiwal, Frank Neese, Dimitrios A Pantazis
Journal of Chemical Theory and Computation|November 24, 2015
A Hierarchy of Methods for the Energetically Accurate Modeling of Isomerism in MonosaccharidesW M C Sameera, Dimitrios A Pantazis
Journal of the American Chemical Society|March 27, 2013
On the magnetic and spectroscopic properties of high-valent Mn3CaO4 cubanes as structural units of natural and artificial water-oxidizing catalystsVera Krewald, Frank Neese, Dimitrios A Pantazis
Journal of Chemical Theory and Computation|February 4, 2016
Improved Segmented All-Electron Relativistically Contracted Basis Sets for the LanthanidesDaniel Aravena, Frank Neese, Dimitrios A Pantazis
Chemical Science|September 15, 2023
Triplet states in the reaction center of Photosystem IISinjini Bhattacharjee, Frank Neese, Dimitrios A Pantazis
Angewandte Chemie (International Ed. in English)|April 8, 2021
Orientational Jahn-Teller Isomerism in the Dark-Stable State of Nature's Water OxidaseMaria Drosou, Georgia Zahariou, Dimitrios A Pantazis
Physical Chemistry Chemical Physics : PCCP|January 15, 2016
Redox potential tuning by redox-inactive cations in nature's water oxidizing catalyst and synthetic analoguesVera Krewald, Frank Neese, Dimitrios A Pantazis
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