Eva Rauls

Professor for Theoretical Physics

Stavanger
Det teknisk-naturvitenskapelige fakultet
Institutt for matematikk og fysikk
KE E-528

Bio

Research interests:

I am mainly using computational methods for investigating (macro-)molecular adsorbates, catalytic and electronic properties of single and selforganised molecules on various surfaces (like metals or graphitic surfaces).  The methods include both first principles and (semi-)empirical methods.

Currently, I am cooperating closely with the chemistry department on two new research projects. These projects include the study and functional design of supramolecular materials for gas sepration with a special focus on CO2-storage as well as the optimization of MOFs for separation and recycling of metals.

 

Short bio:

  • Diploma in theoretical physics, University of Paderborn, Germany (2000)

  • Dr. rer. nat. in theoretical physics, University of Paderborn, Germany (2003)

  • Feodor-Lynen-fellowship of the Alexander-von-Humboldt-Society, Aarhus (iNano), Denmark (2004-2006)

  • Post-doc and leader of independent research group “Computational materials science”, University of Paderborn, Germany (2009-2016)

  • Substitute professor of theortical physics, University of Osnabrück, (2013-2015)

  • Full professor, University of Stavanger (since 2017)

Publikasjoner
  • Vitenskapelige publikasjoner
  • Bøker og kapitler
  • Formidling
    • Bollabathini, Venkatesh; Ho, Quoc Duy; Rauls, Eva; Chavan, Sachin Maruti; Jørgensen, Kåre Bredeli

      (2023)

      Pillararenes - Cage Molecules with a Potential for CO2 Capture.

      OKV36 Organisk kjemisk vintermøte;

      2023-01-05 - 2023-01-08.

    • Rauls, Eva; Gerstmann, Uwe; Tegenkamp, Christoph; Nguyen, Nhung Thi Trang

      (2023)

      Impact of screening and relaxation on weakly coupled 2D heterostructures: implications for molecular spin-coupling.

      DPG-Tagung der Deutschen Physikalischen Gesellschaft;

      2023-03-26 - 2023-03-31.

    • Rauls, Eva

      (2022)

      IMPACT OF SCREENING AND RELAXATION ON WEAKLY COUPLED 2D HETEROSTRUCTURES: IMPLICATIONS FOR SWITCHABLE MOLECULAR SPIN-COUPLING.

      MolQuest;

      2022-08-21 - 2022-08-26.

    • Rauls, Eva

      (2022)

      Atomistic Modelling at IMF.

      Modellering -- Fakultetsseminar UiS;

      2022-11-26.

    • Rauls, Eva

      (2022)

      The interesting properties of macromolecular adsorbates.

      University Seminar Bremen;

      2022-03-18.

    • Lips, Klaus; Gerstmann, Uwe; Rauls, Eva

      (2021)

      Operando characterization of silicon heterojunction solar cells on the nanoscale with conduction AFM and electron spin resonance.

      XIX Brazil MRS Meeting IUMRS ICEM 2021;

      2021-08-30 - 2021-09-03.

    • Rauls, Eva

      (2019)

      On-Surface Site-Selective Chemical Conversions
 of Free Base Corroles on Ag(111) and Manganese Centered Corroles .

      MGHC19, ;

      2019-12-13 - 2019-12-15.

    • Rauls, Eva

      (2019)

      On-surface site-selective chemical conversions - macromolecules on Ag(111) .

      Trends in Nanotechnology, TNT 2019;

      2019-09-30 - 2019-10-04.

    • Rauls, Eva; Gerstmann, Uwe

      (2019)

      Thin ice under pressure on graphene - a theoretical NMR study.

      European Graphene Forum 2019;

      2019-10-22 - 2019-10-25.

    • Rauls, Eva

      (2019)

      Bias-controlled doping of graphene with ice: a theoretical study.

      European Graphene Forum 2019;

      2019-10-22 - 2019-10-25.

    • Rauls, Eva

      (2018)

      Adsorption of Co- and Cu-Phthalocyanines on Au(100) surfaces.

      ECOSS 34, European Conference on Surface Science;

      2018-08-26 - 2018-08-31.

    • Rauls, Eva

      (2018)

      Identifying on-surface site-selective chemical conversions by theory-aided NEXAFS spectroscopy: Free base corroles on Ag(111).

      ECOSS 34, European Conference on Surface Science;

      2018-08-26 - 2018-08-31.

    • Rauls, Eva; Aldahhak, Hazem

      (2017)

      Free-base Corroles on Ag(111): Measuring and Modelling of On-surface Structural Transformations.

      ECOSS 33;

      2017-08-27 - 2017-09-01.

  • Kunstnerisk produksjon
  • Kommersialisering
  • Cristin hovedlogo, Cristin current research information system in Norway