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Dalton Transactions (Cambridge, England : 2003)|April 27, 2010
Theoretical magnetochemistry of dinuclear manganese complexes: broken symmetry density functional theory investigation on the influence of bridging motifs on structure and magnetismDimitrios A Pantazis, Vera Krewald, Maylis Orio, et al.Accounts of Chemical Research|March 20, 2013
Biological water oxidationNicholas Cox, Dimitrios A Pantazis, Frank Neese, et al.The Journal of Physical Chemistry. A|April 3, 2019
Physical Nature of Differential Spin-State Stabilization of Carbenes by Hydrogen and Halogen Bonding: A Domain-Based Pair Natural Orbital Coupled Cluster StudyReza Ghafarian Shirazi, Frank Neese, Dimitrios A Pantazis, et al.Inorganic Chemistry|May 3, 2021
Converged Structural and Spectroscopic Properties for Refined QM/MM Models of AzurinChristine E Schulz, Maurice van Gastel, Dimitrios A Pantazis, et al.Journal of Chemical Theory and Computation|December 2, 2015
All-Electron Scalar Relativistic Basis Sets for Third-Row Transition Metal AtomsDimitrios A Pantazis, Xian-Yang Chen, Clark R Landis, et al.Journal of Chemical Theory and Computation|December 2, 2015
Geometries of Third-Row Transition-Metal Complexes from Density-Functional TheoryMichael Bühl, Christoph Reimann, Dimitrios A Pantazis, et al.Physical Chemistry Chemical Physics : PCCP|April 25, 2014
The first tyrosyl radical intermediate formed in the S2-S3 transition of photosystem IIMarius Retegan, Nicholas Cox, Wolfgang Lubitz, et al.Angewandte Chemie (International Ed. in English)|August 22, 2012
Two interconvertible structures that explain the spectroscopic properties of the oxygen-evolving complex of photosystem II in the S2 stateDimitrios A Pantazis, William Ames, Nicholas Cox, et al.Inorganic Chemistry|July 13, 2011
Detailed ab initio first-principles study of the magnetic anisotropy in a family of trigonal pyramidal iron(II) pyrrolide complexesMihail Atanasov, Dmitry Ganyushin, Dimitrios A Pantazis, et al.Journal of Chemical Theory and Computation|February 22, 2022
Ionization Energies and Redox Potentials of Hydrated Transition Metal Ions: Evaluation of Domain-Based Local Pair Natural Orbital Coupled Cluster ApproachesSinjini Bhattacharjee, Miho Isegawa, Miquel Garcia-Ratés, et al.Pageof 61