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Near-infrared Spectroscopy: a New Frontier

Near-infrared Spectroscopy: a New Frontier

Justyna Ewa Grabska (ORCID: 0000-0002-9280-2902)
  • Grant DOI 10.55776/V1014
  • Funding program Elise Richter
  • Status ongoing
  • Start August 1, 2023
  • End January 31, 2027
  • Funding amount € 365,153

Matching Funds - Tirol

Disciplines

Chemistry (100%)

Keywords

    Vibrational Spectroscopy, Near-Infrared Spectroscopy, Intermolecular Interactions, Anharmonic Methods Spectra-Structure Relationships, Spectra Simulation

Abstract

Worldwide unique research direction, exceptional expertise, and top international collaboration network: these are the pillars of this innovative project to revolutionize the field of analytical chemistry. The Leader of this project, Dr. Justyna Grabska (University of Innsbruck) has brought her unique expertise and passion to Tirol from Japan, to explore the fundamental science behind near-infrared (NIR) spectroscopy a game-changing instrument used in analytical applications and quality control in science and industry. The project team will be working with renowned centers of excellence, including Dr. T. Nakajima from the prestigious RIKEN Center for Computational Science in Japan and leading spectroscopy experts, Prof. Y. Ozaki (Japan) and Prof. H. Siesler (Germany). At its core, this project will advance the fundamental understanding of NIR spectroscopy as a powerful analytical instrument widely used in science and industry. To achieve this goal, the project will combine state-of-the-art computer simulations and data science with advanced experimental methods, the project will provide unprecedented insights into the underlying chemical and physical processes governing NIR spectroscopy. The outcomes of the project have the potential to revolutionize the field, leading to more accurate and reliable analytical tools for a wide range of applications. Through the Elise Richter program, this project aims to support the career path towards scientific independence of innovative, young female researchers, while also empowering the next generation of scientists in Austria. By enabling Dr. Grabska to pursue her path to Habilitation and providing exceptional training in computer simulation, data-science, and modern methods of experimental analytical chemistry to passionate student assistants, the project prepares them to contribute to the rapidly evolving landscape of Industry 4.0 in the region. With the combined support of the Austrian Science Fund (FWF) and the Government of Tirol, this project reinforces Dr. Grabska`s unique and globally recognized research direction, which will increase the scientific visibility of the University of Innsbruck and the region. The project`s focus on an analytical technique with paramount importance in a wide range of industries, including agriculture, food, materials, and pharmaceuticals, positions it to make significant contributions not only to fundamental science but also to practical applications in these critically important sectors of public interest. As a result, the project reinforces Tirol`s position as a hub of innovation and excellence, securing its place as a leader in the global arena of science and technology.

Research institution(s)
  • Universität Innsbruck - 100%
International project participants
  • Heinz Wilhelm Siesler, University of Duisburg-Essen - Germany
  • Yukihiro Ozaki, Kwansei-Gakuin University - Japan
  • Takahito Nakajima, RIKEN - Japan

Research Output

  • 3 Citations
  • 3 Publications
  • 7 Disseminations
  • 5 Scientific Awards
Publications
  • 2024
    Title Carbonyl stretching band in amides as Lorentz oscillator. Insights into anharmonicity and local environment in the liquid phase from NIR and MIR spectra of N-methylformamide and di-N,N-methylformamide
    DOI 10.1016/j.saa.2024.124954
    Type Journal Article
    Author Bec K
    Journal Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy
    Pages 124954
    Link Publication
  • 2025
    Title Standardizing NIR spectroscopy for PAT in phytopharmaceutical applications: multivariate detection and quantification limits of vitexin and isovitexin
    DOI 10.1007/s00216-025-06209-z
    Type Journal Article
    Author Bec K
    Journal Analytical and Bioanalytical Chemistry
    Pages 151-165
    Link Publication
  • 2025
    Title Quantitative Analysis Of Microplastics In Soil Using Near-Infrared Spectroscopy (Master Thesis)
    Type Other
    Author Alexandra Maria Warzilek
Disseminations
  • 2023
    Title Workshop tutor on ICNIR2023, Innsbruck, Austria
    Type Participation in an activity, workshop or similar
  • 2023
    Title Internal Seminar Presentation for Undergraduate/Postgraduate Students
    Type A talk or presentation
  • 2025
    Title Co-supervision of Master Thesis of a Student Assistant employed in this project
    Type A formal working group, expert panel or dialogue
  • 2023
    Title Chairperson at Scientific Conference ICAVS2023
    Type Participation in an activity, workshop or similar
  • 2023
    Title Chairperson at Scientific Conference ICNIR2023
    Type Participation in an activity, workshop or similar
  • 2024
    Title Poster presentation at the CMBI meeting
    Type A talk or presentation
  • 2025
    Title Session organizer (and session chair) "Next-Generation Vibrational Spectroscopy: The Path Ahead"
    Type Participation in an activity, workshop or similar
Scientific Awards
  • 2025
    Title Invited Speaker (awarded with complimentary registration) to the Pittcon 2025
    Type Personally asked as a key note speaker to a conference
    Level of Recognition Continental/International
  • 2025
    Title Invited Speaker (awarded with complimentary registration) to the 5th Aquaphotomics International Conference
    Type Personally asked as a key note speaker to a conference
    Level of Recognition Continental/International
  • 2024
    Title Invited Speaker (awarded with complimentary registration) to the 7th International Congress on Biophotonics (ICOB 2024)
    Type Personally asked as a key note speaker to a conference
    Level of Recognition Continental/International
  • 2024
    Title Invited Speaker (awarded with complimentary registration and travel) to the Mini-Symposium "Next Generation Analytical Chemists" (ASAC 2024)
    Type Personally asked as a key note speaker to a conference
    Level of Recognition Continental/International
  • 2023
    Title Invited Speaker (awarded with complimentary registration) to the SCIX 2023
    Type Personally asked as a key note speaker to a conference
    Level of Recognition Continental/International

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office(at)fwf.ac.at
+43 1 505 67 40

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