Dimitrios A Pantazis

Affiliations

Max-Planck-Institut für Kohlenforschung, Kaiser-Wilhelm-Platz 1, 45470, Mülheim an der Ruhr, Germany.

ORCID: 0000-0002-2146-9065

Publications (20)

Comparison of Density Functional and Correlated Wave Function Methods for the Prediction of Cu(II) Hyperfine Coupling Constants.

Chemphyschem : a European journal of chemical physics and physical chemistry

Avec: Rogelio J Gómez-Piñeiro , Dimitrios A Pantazis , Maylis Orio

Ionization Energies and Redox Potentials of Hydrated Transition Metal Ions: Evaluation of Domain-Based Local Pair Natural Orbital Coupled Cluster Approaches.

Journal of chemical theory and computation

Avec: Sinjini Bhattacharjee , Miho Isegawa , Miquel Garcia-Ratés , Frank Neese , Dimitrios A Pantazis

Decoding the Ambiguous Electron Paramagnetic Resonance Signals in the Lytic Polysaccharide Monooxygenase from

Inorganic chemistry

Avec: Rogelio J Gómez-Piñeiro , Maria Drosou , Sylvain Bertaina , Christophe Decroos , A Jalila Simaan , Dimitrios A Pantazis , Maylis Orio

Selective incorporation of 5-hydroxytryptophan blocks long range electron transfer in oxalate decarboxylase.

Protein science : a publication of the Protein Society

Avec: Anthony John Pastore , Alvaro Montoya , Manasi Kamat , Kari B Basso , James S Italia , Abhishek Chatterjee , Maria Drosou , Dimitrios A Pantazis , Alexander Angerhofer

Accurate computed spin-state energetics for Co(iii) complexes: implications for modelling homogeneous catalysis.

Dalton transactions (Cambridge, England : 2003)

Avec: Samuel E Neale , Dimitrios A Pantazis , Stuart A Macgregor

All-electron scalar relativistic basis sets for the elements Rb-Xe.

Journal of computational chemistry

Avec: Julian D Rolfes , Frank Neese , Dimitrios A Pantazis

Orbital Entanglement Analysis of Exchange-Coupled Systems.

The journal of physical chemistry letters

Avec: Christopher J Stein , Dimitrios A Pantazis , Vera Krewald

Calcium Valence-to-Core X-ray Emission Spectroscopy: A Sensitive Probe of Oxo Protonation in Structural Models of the Oxygen-Evolving Complex.

Inorganic chemistry

Avec: Zachary Mathe , Dimitrios A Pantazis , Heui Beom Lee , Richard Gnewkow , Benjamin E Van Kuiken , Theodor Agapie , Serena DeBeer

Electrostatic profiling of photosynthetic pigments: implications for directed spectral tuning.

Physical chemistry chemical physics : PCCP

Avec: Abhishek Sirohiwal , Dimitrios A Pantazis

How Can We Predict Accurate Electrochromic Shifts for Biochromophores? A Case Study on the Photosynthetic Reaction Center.

Journal of chemical theory and computation

Avec: Abhishek Sirohiwal , Frank Neese , Dimitrios A Pantazis

Reversible Silylium Transfer between P-H and Si-H Donors.

Angewandte Chemie (International ed. in English)

Avec: Roman G Belli , Dimitrios A Pantazis , Robert McDonald , Lisa Rosenberg

Triplet states in the reaction center of Photosystem II.

Chemical science

Avec: Sinjini Bhattacharjee , Frank Neese , Dimitrios A Pantazis

Copper Complexes with Diazoolefin Ligands and their Photochemical Conversion into Alkenylidene Complexes.

Angewandte Chemie (International ed. in English)

Avec: Bastiaan Kooij , Paul Varava , Farzaneh Fadaei-Tirani , Rosario Scopelliti , Dimitrios A Pantazis , Gerard P Van Trieste , David C Powers , Kay Severin

Exploring Electrophilic Hydrophosphination via Metal Phosphenium Intermediates.

Chemistry (Weinheim an der Bergstrasse, Germany)

Avec: Roman G Belli , Vanessa Muir , Nicholas B Dyck , Dimitrios A Pantazis , Tânia P A Sousa , Carly R Slusar , Hayley C Parkin , Lisa Rosenberg

Closing Kok's cycle of nature's water oxidation catalysis.

Nature communications

Avec: Yu Guo , Lanlan He , Yunxuan Ding , Lars Kloo , Dimitrios A Pantazis , Johannes Messinger , Licheng Sun

Elucidating substrate binding in the light-dependent protochlorophyllide oxidoreductase.

Chemical science

Avec: Penelope Pesara , Katarzyna Szafran , Henry C Nguyen , Abhishek Sirohiwal , Dimitrios A Pantazis , Michal Gabruk

Isolation and reactivity of an elusive diazoalkene.

Nature chemistry

Avec: P W Antoni , C Golz , J J Holstein , D A Pantazis , M M Hansmann

Protein Matrix Control of Reaction Center Excitation in Photosystem II.

Journal of the American Chemical Society

Avec: Abhishek Sirohiwal , Frank Neese , Dimitrios A Pantazis

Orientational Jahn-Teller Isomerism in the Dark-Stable State of Nature's Water Oxidase.

Angewandte Chemie (International ed. in English)

Avec: Maria Drosou , Georgia Zahariou , Dimitrios A Pantazis

Successes, challenges, and opportunities for quantum chemistry in understanding metalloenzymes for solar fuels research.

Chemical communications (Cambridge, England)

Avec: Maylis Orio , Dimitrios A Pantazis

Réseau de co-auteurs

Frank Neese 5 collaborations

Abhishek Sirohiwal 4 collaborations

Maylis Orio 3 collaborations

Maria Drosou 3 collaborations

Rogelio J Gómez-Piñeiro 2 collaborations

Sinjini Bhattacharjee 2 collaborations

Roman G Belli 2 collaborations

Lisa Rosenberg 2 collaborations

Miho Isegawa 1 collaboration

Miquel Garcia-Ratés 1 collaboration

Sylvain Bertaina 1 collaboration

Christophe Decroos 1 collaboration

A Jalila Simaan 1 collaboration

Anthony John Pastore 1 collaboration

Alvaro Montoya 1 collaboration

Manasi Kamat 1 collaboration

Kari B Basso 1 collaboration

James S Italia 1 collaboration

Abhishek Chatterjee 1 collaboration

Alexander Angerhofer 1 collaboration

Samuel E Neale 1 collaboration

Stuart A Macgregor 1 collaboration

Julian D Rolfes 1 collaboration

Christopher J Stein 1 collaboration

Vera Krewald 1 collaboration

Zachary Mathe 1 collaboration

Heui Beom Lee 1 collaboration

Richard Gnewkow 1 collaboration

Benjamin E Van Kuiken 1 collaboration

Theodor Agapie 1 collaboration

Serena DeBeer 1 collaboration

Robert McDonald 1 collaboration

Bastiaan Kooij 1 collaboration

Paul Varava 1 collaboration

Farzaneh Fadaei-Tirani 1 collaboration

Rosario Scopelliti 1 collaboration

Gerard P Van Trieste 1 collaboration

David C Powers 1 collaboration

Kay Severin 1 collaboration

Vanessa Muir 1 collaboration

Nicholas B Dyck 1 collaboration

Tânia P A Sousa 1 collaboration

Carly R Slusar 1 collaboration

Hayley C Parkin 1 collaboration

Yu Guo 1 collaboration

Lanlan He 1 collaboration

Yunxuan Ding 1 collaboration

Lars Kloo 1 collaboration

Johannes Messinger 1 collaboration

Licheng Sun 1 collaboration

Penelope Pesara 1 collaboration

Katarzyna Szafran 1 collaboration

Henry C Nguyen 1 collaboration

Michal Gabruk 1 collaboration

P W Antoni 1 collaboration

C Golz 1 collaboration

J J Holstein 1 collaboration

D A Pantazis 1 collaboration

M M Hansmann 1 collaboration

Georgia Zahariou 1 collaboration