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Chemistry

D-Index
64
Citations
24689
World Ranking
7906
National Ranking
198

Overview

Henrik Koch is affiliated with the Scuola Normale Superiore di Pisa in Italy. Their research primarily spans the domain of Physics and Astronomy, with a strong focus on Atomic and Molecular Physics, and Optics. Additionally, their work encompasses Physical and Theoretical Chemistry, Electrical and Electronic Engineering, Materials Chemistry, and Spectroscopy.

Their major research topics include Spectroscopy and Quantum Chemical Studies, Advanced Chemical Physics Studies, Strong Light-Matter Interactions, Photochemistry and Electron Transfer Studies, Molecular Junctions and Nanostructures, Quantum Information and Cryptography, and Quantum and Electron Transport Phenomena.

Henrik Koch has contributed significantly to recent scientific literature with notable papers such as:

  • Molecular orbital theory in cavity QED environments, 2022, Nature Communications
  • Strong Coupling between Localized Surface Plasmons and Molecules by Coupled Cluster Theory, 2021, Nano Letters
  • Strong Coupling in Chiral Cavities: Nonperturbative Framework for Enantiomer Discrimination, 2023, Physical Review X
  • Equation-of-motion coupled-cluster method with double electron-attaching operators: Theory, implementation, and benchmarks, 2021, The Journal of Chemical Physics
  • Accurate Description of Photoionization Dynamical Parameters, 2020, The Journal of Physical Chemistry Letters

The frequent co-authors of Henrik Koch include Sarai Dery Folkestad, Eirik F. Kjønstad, Enrico Ronca, Alexander C. Paul, and Sonia Coriani. These collaborations span a wide range of research activities reflecting interdisciplinary approaches within their fields.

Henrik Koch's publications appear often in venues such as:

  • arXiv (Cornell University)
  • Journal of Chemical Theory and Computation
  • Zenodo (CERN European Organization for Nuclear Research)
  • The Journal of Chemical Physics
  • The Journal of Physical Chemistry Letters

Best Publications

  • Basis-set convergence of correlated calculations on water

    Trygve Helgaker;Wim Klopper;Henrik Koch;Jozef Noga

  • Basis-set convergence in correlated calculations on Ne, N2, and H2O

    Asger Halkier;Trygve Helgaker;Poul Jørgensen;Wim Klopper

  • The second-order approximate coupled cluster singles and doubles model CC2

    Ove Christiansen;Henrik Koch;Poul Jørgensen

  • Coupled cluster response functions

    Henrik Koch;Poul Jo;rgensen

  • The Dalton quantum chemistry program system

    Kestutis Aidas;Celestino Angeli;Keld L. Bak;Vebjørn Bakken

  • Excitation energies from the coupled cluster singles and doubles linear response function (CCSDLR). Applications to Be, CH+, CO, and H2O

    Henrik Koch;Hans Jørgen Aa. Jensen;Poul Jørgensen;Trygve Helgaker

  • Response functions in the CC3 iterative triple excitation model

    Ove Christiansen;Henrik Koch;Poul Jørgensen

  • Dalton, a molecular electronic structure program

    H. Agren;David John. Wilson;O. Vahtras;P. R. Taylor

  • The CC3 model: An iterative coupled cluster approach including connected triples

    Henrik Koch;Ove Christiansen;Poul Jørgensen;Alfrede M. Sanchez De Merás

  • Reduced scaling in electronic structure calculations using Cholesky decompositions

    Henrik Koch;Alfredo Sánchez de Merás;Thomas Bondo Pedersen

  • Calculation of size‐intensive transition moments from the coupled cluster singles and doubles linear response function

    Henrik Koch;Rika Kobayashi;Alfredo Sanchez de Merás;Poul Jo

  • Full configuration-interaction and state of the art correlation calculations on water in a valence double-zeta basis with polarization functions

    Jeppe Olsen;Poul Jørgensen;Henrik Koch;Anna Balkova

  • Excitation energies of BH, CH2 and Ne in full configuration interaction and the hierarchy CCS, CC2, CCSD and CC3 of coupled cluster models

    Henrik Koch;Ove Christiansen;Poul Jørgensen;Jeppe Olsen

  • Coupled cluster energy derivatives. Analytic Hessian for the closed‐shell coupled cluster singles and doubles wave function: Theory and applications

    Henrik Koch;Hans Jørgen Aa. Jensen;Poul Jørgensen;Trygve Helgaker

  • Perturbative triple excitation corrections to coupled cluster singles and doubles excitation energies

    Ove Christiansen;Henrik Koch;Poul Jørgensen

  • Excitation energies of H2O, N2 and C2 in full configuration interaction and coupled cluster theory

    Ove Christiansen;Henrik Koch;Poul Jørgensen;Jeppe Olsen

  • Surprising cases of divergent behavior in Mo/ller–Plesset perturbation theory

    Jeppe Olsen;Ove Christiansen;Henrik Koch;Poul Jo

  • Dalton, a molecular electronic structure program, Release Dalton2011

    C Angeli;K. L. Bak;V. Bakken;O. Christiansen

  • Communication: X-ray absorption spectra and core-ionization potentials within a core-valence separated coupled cluster framework

    Sonia Coriani;Henrik Koch

  • Integral-direct coupled cluster calculations of frequency-dependent polarizabilities, transition probabilities and excited-state properties

    Ove Christiansen;Asger Halkier;Henrik Koch;Poul Jo

  • A systematic ab initio study of the water dimer in hierarchies of basis sets and correlation models

    Asger Halkier;Henrik Koch;Poul Jørgensen;Ove Christiansen

Frequent Co-Authors

Poul Jørgensen
Poul Jørgensen Aarhus University
Trygve Helgaker
Trygve Helgaker University of Oslo
Sonia Coriani
Sonia Coriani Technical University of Denmark
Ove Christiansen
Ove Christiansen Aarhus University
Jeppe Olsen
Jeppe Olsen Aarhus University
Todd J. Martínez
Todd J. Martínez Stanford University
Poul Jo
Poul Jo Aarhus University
Christof Hättig
Christof Hättig Ruhr University Bochum
Kenneth Ruud
Kenneth Ruud University of Tromsø - The Arctic University of Norway
Wim Klopper
Wim Klopper Karlsruhe Institute of Technology

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