Projects per year
Personal profile
Research profile
I am a Tenure-Track Assistant Professor in Materials Chemistry at the Department of Chemistry and Bioscience. My research is focussed on computational materials design of sustainable materials including hybrid organic-inorganic ferroelectric and piezoelectric materials and inorganic solid-state electrolytes. I am particularly interested in the effects of temperature, entropy and disorder on the structure, properties and stability of materials, and I study these effects using quantum chemical, crystallographic and data-driven methods.
I received my PhD in chemistry from Aarhus University in 2020 under the supervision of Prof. Bo Brummerstedt Iversen. I then held an Independent Research Fund Denmark Postdoctoral Fellowship and subsequently a Schmidt Futures AI in Science Postdoctoral Fellowship at Imperial College London, UK, working with Prof. Aron Walsh. In September 2023, I moved to AAU as a Tenure-Track Assistant Professor to start my independent research group.
Expertise related to UN Sustainable Development Goals
In 2015, UN member states agreed to 17 global Sustainable Development Goals (SDGs) to end poverty, protect the planet and ensure prosperity for all. This person’s work contributes towards the following SDG(s):
Keywords
- Chemistry and Bioscience
- Materials chemistry
- Computational Chemistry
- Energy materials
- Crystallography
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Collaborations from the last five years
Projects
- 1 Active
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NNF Start Package Grant
Tolborg, K. (PI) & Timothée, J. (Project Participant)
01/01/2024 → 31/12/2027
Project: Research
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Low-Cost Vibrational Free Energies in Solid Solutions with Machine Learning Force Fields
Tolborg, K. & Walsh, A., 28 Dec 2023, In: The Journal of Physical Chemistry Letters. 14, 51, p. 11618-11624 7 p.Research output: Contribution to journal › Journal article › Research › peer-review
Open AccessFile2 Citations (Scopus)15 Downloads (Pure) -
Models of orientational disorder in hybrid organic-inorganic piezoelectric materials
Tolborg, K. & Walsh, A., 6 Jun 2023, In: Journal of Materials Chemistry C. 11, 26, p. 8885-8891 7 p.Research output: Contribution to journal › Journal article › Research › peer-review
Open Access2 Citations (Scopus) -
Free energy predictions for crystal stability and synthesisability
Tolborg, K., Klarbring, J., Ganose, A. M. & Walsh, A., 1 Oct 2022, In: Digital Discovery. 1, 5, p. 586-595 10 p.Research output: Contribution to journal › Journal article › Research › peer-review
Open Access24 Citations (Scopus) -
Coordination Sphere Flexibility Leads to Elastic Deformation in a One-Dimensional Coordination Polymer Crystal
Thomas, S. P., Worthy, A., Eikeland, E. Z., Thompson, A. J., Grosjean, A., Tolborg, K., Krause, L., Sugimoto, K., Spackman, M. A., McMurtrie, J. C., Clegg, J. K. & Iversen, B. B., 28 Mar 2023, In: Chemistry of Materials. 35, 6, p. 2495-2502 8 p.Research output: Contribution to journal › Journal article › Research › peer-review
14 Citations (Scopus) -
Exploring the High-Temperature Stabilization of Cubic Zirconia from Anharmonic Lattice Dynamics
Tolborg, K. & Walsh, A., 3 May 2023, In: Crystal Growth and Design. 23, 5, p. 3314-3319 6 p.Research output: Contribution to journal › Journal article › Research › peer-review
Open Access5 Citations (Scopus)
Activities
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Modelling the interplay between disorder and vibrations in crystalline materials
Tolborg, K. (Lecturer)
12 Nov 2024Activity: Talks and presentations › Conference presentations
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Machine learning force fields for vibrational entropy
Tolborg, K. (Lecturer)
25 Sept 2024Activity: Talks and presentations › Conference presentations
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Censorkorpset i kemi (External organisation)
Tolborg, K. (Member)
2024 → …Activity: Memberships › Membership of committees, commissions, boards, councils, associations, organisations, or similar
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Vibrations for Free: Fast Calculations of Vibrational Free Energies in Solid Solutions with Machine Learned Force Fields
Tolborg, K. (Lecturer)
28 Nov 2023Activity: Talks and presentations › Conference presentations
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Modelling Orientational Disorder and Phase Transitions in Hybrid Piezoelectric Materials from First Principles
Tolborg, K. (Lecturer)
28 Nov 2023Activity: Talks and presentations › Conference presentations
Press/Media
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Andreas Mogensen hædret med H.C. Ørsted Forskerprisen da Ørstedskolen fejrede videnskaben
14/08/2024
1 item of Media coverage
Press/Media: Press / Media
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Andreas Mogensen får H.C. Ørsted-prisen
31/07/2024 → 01/08/2024
4 items of Media coverage
Press/Media: Press / Media