D-Index & Metrics Best Publications

D-Index & Metrics D-index (Discipline H-index) only includes papers and citation values for an examined discipline in contrast to General H-index which accounts for publications across all disciplines.

Discipline name D-index D-index (Discipline H-index) only includes papers and citation values for an examined discipline in contrast to General H-index which accounts for publications across all disciplines. Citations Publications World Ranking National Ranking
Chemistry D-index 64 Citations 14,296 273 World Ranking 5058 National Ranking 402

Overview

What is he best known for?

The fields of study he is best known for:

  • Quantum mechanics
  • Molecule
  • Organic chemistry

Dominik Marx focuses on Chemical physics, Ab initio, Molecule, Molecular dynamics and Electronic structure. His Chemical physics study combines topics in areas such as Hydrogen, Solvation, Hydrogen bond, Computational chemistry and Proton. His Ab initio study combines topics from a wide range of disciplines, such as Path integral molecular dynamics, Software engineering, Ab initio quantum chemistry methods and Density functional theory.

His research integrates issues of Monolayer, Adsorption, Stereochemistry, Dissociation and Scanning tunneling microscope in his study of Molecule. Dominik Marx has researched Molecular dynamics in several fields, including Bacteriorhodopsin, Molecular physics, Excited state, Proton transport and Infrared spectroscopy. His Electronic structure research incorporates elements of Plane wave, SIESTA, Theoretical physics, Chemical bond and Basis set.

His most cited work include:

  • The nature of the hydrated excess proton in water (1212 citations)
  • Ab initio molecular dynamics: basic theory and advanced methods (653 citations)
  • Proton transfer 200 years after von Grotthuss: insights from ab initio simulations. (571 citations)

What are the main themes of his work throughout his whole career to date?

His main research concerns Chemical physics, Ab initio, Molecule, Molecular dynamics and Computational chemistry. His Chemical physics study integrates concerns from other disciplines, such as Solvation, Cluster, Hydrogen bond, Atomic physics and Proton. Dominik Marx usually deals with Solvation and limits it to topics linked to Aqueous solution and Inorganic chemistry.

His Ab initio course of study focuses on Ab initio quantum chemistry methods and Molecular physics. His work in Molecule tackles topics such as Infrared spectroscopy which are related to areas like Dipole. His biological study spans a wide range of topics, including Photochemistry, Proton transport and Physical chemistry.

He most often published in these fields:

  • Chemical physics (34.35%)
  • Ab initio (24.01%)
  • Molecule (22.80%)

What were the highlights of his more recent work (between 2015-2021)?

  • Chemical physics (34.35%)
  • Solvation (16.41%)
  • Molecule (22.80%)

In recent papers he was focusing on the following fields of study:

The scientist’s investigation covers issues in Chemical physics, Solvation, Molecule, Ab initio and Aqueous solution. His Chemical physics research incorporates themes from Potential energy surface, Molecular dynamics, Spectroscopy, Dielectric and Intramolecular force. His studies in Solvation integrate themes in fields like Alcohol oxidation, Hydronium, Heterogeneous catalysis and Intermolecular force.

While the research belongs to areas of Molecule, he spends his time largely on the problem of Colloidal gold, intersecting his research to questions surrounding Oxygen. His studies deal with areas such as Photochemistry and Dissociation as well as Ab initio. Dominik Marx has included themes like Polarization, Electronic structure and Terahertz radiation in his Aqueous solution study.

Between 2015 and 2021, his most popular works were:

  • Design principles for high–pressure force fields: Aqueous TMAO solutions from ambient to kilobar pressures (41 citations)
  • Chemistry in nanoconfined water (37 citations)
  • Unexpected mechanochemical complexity in the mechanistic scenarios of disulfide bond reduction in alkaline solution (35 citations)

In his most recent research, the most cited papers focused on:

  • Quantum mechanics
  • Molecule
  • Organic chemistry

Dominik Marx spends much of his time researching Chemical physics, Ab initio, Solvation, Molecule and Photochemistry. His work carried out in the field of Chemical physics brings together such families of science as Dipole, Proton, Atomic physics and Terahertz radiation. His Ab initio research integrates issues from Electronic structure, Chemical reaction, Dissociation and Aqueous solution.

His Solvation research includes themes of Amino acid, Biophysics and Hydronium. Dominik Marx combines subjects such as Computational chemistry and Amide with his study of Amino acid. His study in Molecule is interdisciplinary in nature, drawing from both Stereochemistry and Infrared spectroscopy.

This overview was generated by a machine learning system which analysed the scientist’s body of work. If you have any feedback, you can contact us here.

Best Publications

The nature of the hydrated excess proton in water

Dominik Marx;Mark E. Tuckerman;Jürg Hutter;Michele Parrinello.
Nature (1999)

1817 Citations

Proton transfer 200 years after von Grotthuss: insights from ab initio simulations.

Dominik Marx.
ChemPhysChem (2006)

837 Citations

Density-functional study of the structure and stability of ZnO surfaces

B. Meyer;Dominik Marx.
Physical Review B (2003)

812 Citations

On the quantum nature of the shared proton in hydrogen bonds

Mark E. Tuckerman;Dominik Marx;Michael L. Klein;Michele Parrinello.
Science (1997)

812 Citations

Ab Initio Molecular Dynamics: Basic Theory and Advanced Methods

Dominik Marx;Jürg Hutter.
Physics Today (2009)

674 Citations

AB INITIO PATH INTEGRAL MOLECULAR DYNAMICS : BASIC IDEAS

Dominik Marx;Michele Parrinello.
Journal of Chemical Physics (1996)

484 Citations

Aqueous Basic Solutions: Hydroxide Solvation, Structural Diffusion, and Comparison to the Hydrated Proton

Dominik Marx;Amalendu Chandra;Mark E. Tuckerman.
Chemical Reviews (2010)

446 Citations

Tunnelling and zero-point motion in high-pressure ice

Magali Benoit;Dominik Marx;Michele Parrinello.
Nature (1998)

432 Citations

Dissecting the THz spectrum of liquid water from first principles via correlations in time and space.

Matthias Heyden;Jian Sun;Stefan Funkner;Gerald Mathias;Gerald Mathias.
Proceedings of the National Academy of Sciences of the United States of America (2010)

414 Citations

Ab initio molecular dynamics: Theory and Implementation

Dominik Marx.
(2000)

400 Citations

If you think any of the details on this page are incorrect, let us know.

Contact us

Best Scientists Citing Dominik Marx

Mark E. Tuckerman

Mark E. Tuckerman

New York University

Publications: 84

Gregory A. Voth

Gregory A. Voth

University of Chicago

Publications: 68

Martina Havenith

Martina Havenith

Ruhr University Bochum

Publications: 60

Amalendu Chandra

Amalendu Chandra

Indian Institute of Technology Kanpur

Publications: 51

Michele Parrinello

Michele Parrinello

ETH Zurich

Publications: 51

Marie-Pierre Gaigeot

Marie-Pierre Gaigeot

University of Évry Val d'Essonne

Publications: 38

Chang Q. Sun

Chang Q. Sun

Nanyang Technological University

Publications: 38

Rodolphe Vuilleumier

Rodolphe Vuilleumier

École Normale Supérieure

Publications: 36

R. Benny Gerber

R. Benny Gerber

Hebrew University of Jerusalem

Publications: 35

James T. Hynes

James T. Hynes

University of Colorado Boulder

Publications: 34

Yuemin Wang

Yuemin Wang

Karlsruhe Institute of Technology

Publications: 33

Christof Wöll

Christof Wöll

Karlsruhe Institute of Technology

Publications: 33

Joel M. Bowman

Joel M. Bowman

Emory University

Publications: 33

Roberto Car

Roberto Car

Princeton University

Publications: 31

Ursula Rothlisberger

Ursula Rothlisberger

École Polytechnique Fédérale de Lausanne

Publications: 31

Martin Muhler

Martin Muhler

Ruhr University Bochum

Publications: 31

Trending Scientists

Lori A. Clarke

Lori A. Clarke

University of Massachusetts Amherst

Florence Yean Yng Ling

Florence Yean Yng Ling

National University of Singapore

lester f eastman

lester f eastman

Cornell University

Asif Ekbal

Asif Ekbal

Indian Institute of Technology Patna

Sanjaya D. Senanayake

Sanjaya D. Senanayake

Brookhaven National Laboratory

Michael B. Hursthouse

Michael B. Hursthouse

University of Southampton

Ken Haenen

Ken Haenen

Hasselt University

Mitsuhiro Kato

Mitsuhiro Kato

Showa University

Teofilo A. Abrajano

Teofilo A. Abrajano

Rensselaer Polytechnic Institute

Chao Luo

Chao Luo

University of California, Santa Barbara

Jean-Pascal Lefaucheur

Jean-Pascal Lefaucheur

Université Paris Cité

Hao Shen

Hao Shen

University of Pennsylvania

Thomas E. Van Dyke

Thomas E. Van Dyke

Harvard University

Seth M. Noar

Seth M. Noar

University of North Carolina at Chapel Hill

Geraldine Downey

Geraldine Downey

Columbia University

Something went wrong. Please try again later.