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Chemistry

D-Index
65
Citations
13542
World Ranking
7751
National Ranking
35

Overview

Dage Sundholm is affiliated with the University of Helsinki in Finland and specializes in research at the intersection of chemistry and materials science. Their work spans significant areas within both fields, including materials chemistry, organic chemistry, and physical and theoretical chemistry. Additionally, their expertise extends to atomic and molecular physics, optics, as well as electrical and electronic engineering.

The primary focus of their research includes synthesis and properties of aromatic compounds, advanced chemical physics studies, and investigations into porphyrin and phthalocyanine chemistry. Other areas of interest include photochemistry and electron transfer studies, crystallization and solubility studies, X-ray diffraction in crystallography, and fullerene chemistry and applications.

The scientist has contributed extensively to various scientific journals and publication venues. Frequent venues include:

  • Physical Chemistry Chemical Physics
  • The Cambridge Structural Database
  • The Journal of Physical Chemistry A
  • Chemical Science
  • Organic Letters

Among recent papers authored or co-authored by Dage Sundholm are:

  • "Current density and molecular magnetic properties," 2021, Chemical Communications
  • "Aromaticity: Quo Vadis," 2023, Chemical Science
  • "Benchmarking Magnetizabilities with Recent Density Functionals," 2021, Journal of Chemical Theory and Computation
  • "Aromaticity of Even-Number Cycloncarbons (n = 6-100)," 2020, The Journal of Physical Chemistry A
  • "On the origin of the inverted singlet-triplet gap of the 5th generation light-emitting molecules," 2022, Physical Chemistry Chemical Physics

Dage Sundholm has collaborated frequently with researchers including Rashid R. Valiev, Maria Dimitrova, Rinat T. Nasibullin, Heike Fliegl, and Theo Kurtén.

The scientist's contributions also extend to academic publishing in book form, with a publication titled Aromaticity released by Elsevier BV in 2021.

Best Publications

  • The gauge including magnetically induced current method

    Heike Fliegl;Stefan Taubert;Olli Lehtonen;Dage Sundholm

  • Calculation of spin-current densities using gauge-including atomic orbitals

    Stefan Taubert;Dage Sundholm;Jonas Jusélius

  • Au32: a 24-carat golden fullerene

    Mikael P. Johansson;Dage Sundholm;Juha Vaara

  • Calculations of magnetically induced current densities: theory and applications

    Dage Sundholm;Heike Fliegl;Raphael J.F. Berger

  • Fully numerical hartree-fock methods for molecules

    Leif Laaksonen;Pekka Pyykkö;Dage Sundholm

  • Density functional theory calculations of the visible spectrum of chlorophyll a

    Dage Sundholm

  • Ab initio determination of the induced ring current in aromatic molecules

    Jonas Juse′lius;Dage Sundholm

  • Magnetically induced current densities in aromatic, antiaromatic, homoaromatic, and nonaromatic hydrocarbons.

    Heike Fliegl;Dage Sundholm;Stefan Taubert;Jonas Jusélius

  • Rovibrationally averaged nuclear magnetic shielding tensors calculated at the coupled‐cluster level

    Dage Sundholm;Jürgen Gauss;Ansgar Schäfer

  • Repulsive interatomic potentials calculated using Hartree-Fock and density-functional theory methods

    K. Nordlund;N. Runeberg;D. Sundholm

  • Aromaticity: Quo Vadis

    Unknown

  • Cyclo[18]carbon: Insight into Electronic Structure, Aromaticity, and Surface Coupling.

    Glib V. Baryshnikov;Rashid R. Valiev;Rashid R. Valiev;Artem V. Kuklin;Artem V. Kuklin;Dage Sundholm

  • A Numerical Hartree-Fock Program for Diatomic Molecules

    Jacek Kobus;Leif Laaksonen;Dage Sundholm

  • Luminescent Characterization of Solution Oligomerization Process Mediated Gold−Gold Interactions. DFT Calculations on [Au2Ag2R4L2]n Moieties

    Eduardo J. Fernández;M. Concepción Gimeno;Antonio Laguna;‡ José M. López-de-Luzuriaga

  • Two-dimensional, fully numerical molecular calculations

    Dage Sundholm;Pekka Pyykkö;Leif Laaksonen

  • The aromatic pathways of porphins, chlorins and bacteriochlorins

    Jonas Jusélius;Dage Sundholm

  • Interpretation of the electronic absorption spectrum of free-base porphin using time-dependent density-functional theory

    Dage Sundholm

  • Sphere Currents of Buckminsterfullerene

    Mikael P. Johansson;Jonas Jusélius;Dage Sundholm

  • Benchmarking the Performance of Time-Dependent Density Functional Theory Methods on Biochromophores.

    Yihan Shao;Ye Mei;Dage Sundholm;Ville R. I. Kaila

  • First-principles method for calculating the rate constants of internal-conversion and intersystem-crossing transitions

    R. R. Valiev;R. R. Valiev;V. N. Cherepanov;Gleb V. Baryshnikov;Gleb V. Baryshnikov;D. Sundholm

  • Magnetic-Shielding Calculations on Al42- and Analogues. A New Family of Aromatic Molecules?

    Jonas Jusélius;Michal Straka;Dage Sundholm

  • Properties of WAu12

    Jochen Autschbach;Bernd A. Hess;Mikael P. Johansson;Johannes Neugebauer

  • Full configuration interaction calculations of electron-hole correlation effects in strain-induced quantum dots

    M. Braskén;M. Lindberg;D. Sundholm;J. Olsen

Frequent Co-Authors

Jeppe Olsen
Jeppe Olsen Aarhus University
Ville R. I. Kaila
Ville R. I. Kaila Stockholm University
Jürgen Gauss
Jürgen Gauss Johannes Gutenberg University of Mainz
Andrzej J. Sadlej
Andrzej J. Sadlej Nicolaus Copernicus University
Mårten Wikström
Mårten Wikström University of Helsinki
Miguel Monge
Miguel Monge University of La Rioja
José M. López-de-Luzuriaga
José M. López-de-Luzuriaga University of La Rioja
Hubert Schmidbaur
Hubert Schmidbaur Technical University of Munich
Florian Weigend
Florian Weigend Philipp University of Marburg
Hans Ågren
Hans Ågren Uppsala University

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