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Chemistry

D-Index
64
Citations
13814
World Ranking
8088
National Ranking
576

Overview

Uwe Manthe is affiliated with Bielefeld University in Germany and has contributed extensively to the fields of Physics and Astronomy as well as Chemistry. Their research spans 38 publications in Physics and Astronomy and 17 in Chemistry.

Their work is concentrated primarily in subfields such as Atomic and Molecular Physics, and Optics, with 35 publications; Spectroscopy, with 12; Organic Chemistry, with 5; Condensed Matter Physics, with 3; and Materials Chemistry, with 2.

The main topics covered in Manthe's research include Spectroscopy and Quantum Chemical Studies and Advanced Chemical Physics Studies, each with 22 publications. Further focus areas are Quantum, Superfluid, Helium Dynamics (16 publications), Spectroscopy and Laser Applications (10), Advanced NMR Techniques and Applications (8), Physics of Superconductivity and Magnetism (6), and Quantum Many-Body Systems (6).

They have published in several scientific venues, frequently appearing in The Journal of Chemical Physics with 10 publications. Other common venues include The Journal of Physical Chemistry A (2 publications), Nature Chemistry (1), Science Advances (1), and Chemical Physics (1).

Frequent co-authors of Uwe Manthe include:

  • Hannes Hoppe (7 collaborations)
  • Bin Zhao (6 collaborations)
  • Roman Ellerbrock (5 collaborations)
  • Thomas Weike (3 collaborations)
  • Georgyi Koidan (3 collaborations)

Selected recent publications by Manthe include:

  • Full-dimensional quantum stereodynamics of the non-adiabatic quenching of OH(A2Σ+) by H2, 2021, Nature Chemistry
  • The multi-configurational time-dependent Hartree approach in optimized second quantization: Imaginary time propagation and particle number conservation, 2020, The Journal of Chemical Physics
  • Vibrational control of the reaction pathway in the H + CHD3 → H2 + CD3 reaction, 2022, Science Advances
  • Symmetries in the multi-configurational time-dependent Hartree wavefunction representation and propagation, 2021, The Journal of Chemical Physics
  • Non-adiabatic transitions in the reaction of fluorine with methane, 2020, The Journal of Chemical Physics

Best Publications

  • The multi-configurational time-dependent Hartree approach

    HD Meyer;Uwe Manthe;LS Cederbaum

  • Wave‐packet dynamics within the multiconfiguration Hartree framework: General aspects and application to NOCl

    Uwe Manthe;H.‐D. Meyer;Lorenz S Cederbaum

  • A multilayer multiconfigurational time-dependent Hartree approach for quantum dynamics on general potential energy surfaces.

    Uwe Manthe

  • First-Principles Theory for the H + CH4 → H2 + CH3 Reaction

    Tao Wu;Hans-Joachim Werner;Uwe Manthe;Uwe Manthe

  • Full dimensional quantum calculations of the CH4+H→CH3+H2 reaction rate

    Fermı́n Huarte-Larrañaga;Uwe Manthe

  • Multiconfigurational time‐dependent Hartree study of complex dynamics: Photodissociation of NO2

    Uwe Manthe;HD Meyer;LS Cederbaum

  • A time‐dependent discrete variable representation for (multiconfiguration) Hartree methods

    Uwe Manthe

  • Predicting Catalysis: Understanding Ammonia Synthesis from First-Principles Calculations

    A Hellman;E.J. Baerends;M Biczysko;T Bligaard

  • The cumulative reaction probability as eigenvalue problem

    Uwe Manthe;William H. Miller

  • Full‐dimensional quantum mechanical calculation of the rate constant for the H2+OH→H2O+H reaction

    Uwe Manthe;Uwe Manthe;Tamar Seideman;Tamar Seideman;William H. Miller

  • Dynamics on potential energy surfaces with a conical intersection: Adiabatic, intermediate, and diabatic behavior

    Uwe Manthe;H Köppel

  • Quantum mechanical calculations of the rate constant for the H2+OH→H+H2O reaction: Full‐dimensional results and comparison to reduced dimensionality models

    Uwe Manthe;Uwe Manthe;Tamar Seideman;Tamar Seideman;William H. Miller

  • Time‐dependent photodissociation of methyl iodide with five active modes

    Audrey Dell Hammerich;Uwe Manthe;Ronnie Kosloff;Hans‐Dieter Meyer

  • New method for calculating wave packet dynamics: Strongly coupled surfaces and the adiabatic basis

    Uwe Manthe;H Köppel

  • Accurate quantum calculations of thermal rate constants employing MCTDH: H2+OH→H+H2O and D2+OH→D+DOH

    Frank Matzkies;Uwe Manthe

  • Layered discrete variable representations and their application within the multiconfigurational time-dependent Hartree approach

    Uwe Manthe

  • Comparison of quantum dynamics and quantum transition state theory estimates of the H + CH4 reaction rate.

    Stefan Andersson;Gunnar Nyman;Andri Arnaldsson;Uwe Manthe

  • Vibrational excitation in the transition state: The CH4+H→CH3+H2 reaction rate constant in an extended temperature interval

    Fermı́n Huarte-Larrañaga;Uwe Manthe

  • Accurate potential energy surface and quantum reaction rate calculations for the H+CH4-->H2+CH3 reaction.

    Tao Wu;Hans-Joachim Werner;Uwe Manthe

  • The state averaged multiconfigurational time-dependent Hartree approach: vibrational state and reaction rate calculations.

    Uwe Manthe

Frequent Co-Authors

Lorenz S. Cederbaum
Lorenz S. Cederbaum Heidelberg University
Hans-Dieter Meyer
Hans-Dieter Meyer Heidelberg University
Wolfgang Domcke
Wolfgang Domcke Technical University of Munich
Horst Köppel
Horst Köppel Heidelberg University
Tamar Seideman
Tamar Seideman Northwestern University
Joel M. Bowman
Joel M. Bowman Emory University
Hans-Joachim Werner
Hans-Joachim Werner University of Stuttgart
William H. Miller
William H. Miller University of California, Berkeley
Jens K. Nørskov
Jens K. Nørskov Technical University of Denmark
Philipp Gütlich
Philipp Gütlich Johannes Gutenberg University of Mainz

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