Antti Karttunen

Professor (Associate Professor)

Department of Chemistry and Materials Science

I study inorganic materials that can be used for improving energy efficiency. My research group uses quantum chemical methods to investigate the atomic-level structures and properties of inorganic materials.

Current research areas:

Pyroelectric and thermoelectric materials for improving energy efficiency.
New functional materials based on main group elements.
Virtual and extended reality in chemical education.

Full researcher profile

https://research.aalto.fi/...

antti.karttunen@aalto.fi

Postal address

Kemistintie 1 02150 Espoo Finland

Phone number

+358503473475

Areas of expertise

116 Chemical sciences, 1 Natural sciences, Inorganic chemistry, Physical chemistry, Functional materials, semiconductors, Ceramic materials

Honors and awards

Aalto University's Open Science Award 2024

Award or honor granted for a specific work Department of Chemistry and Materials Science Dec 2024

Aalto CHEM Educational action of the year 2020

Awarded to AALTOLAB team

Award or honor granted for a specific work Department of Chemistry and Materials Science Dec 2020

Aalto CHEM Educational action of the year 2018 award

Award or honor granted for a specific work Inorganic Materials Modelling Dec 2018

Aalto University Excellence Recognition in Education

For developing a new blended learning course "Programming course for Chemical Engineering"

Award or honor granted for a specific work Inorganic Materials Modelling Jan 2017

Research groups

Inorganic Materials Modelling, Professor (Associate Professor)

Publications

Simulated Infrared and Raman Spectra of Phosphorus Allotropes

Laura Bonometti, Giuseppe Sansone, Antti J Karttunen, Lorenzo Maschio 2025 Journal of Raman Spectroscopy

Heat transport properties of PbTe_1−xSe_x alloys using equivariant graph neural network interatomic potential

Kevin Conley, Colton Gerber, Andrew Novick, Terra Berriodi, Eric S. Toberer, Antti J. Karttunen 2025 Materials Horizons

Pyroelectric Properties of A-Site Ordered [K_0.5Na_0.5]NbO₃ Perovskite Studied with Hybrid Density Functional Method

Kim Eklund, Antti J. Karttunen 2025 Journal of Physical Chemistry C

Pyroelectric properties of Pb[Zr_0.5Ti_0.5]O₃ studied with a hybrid density functional method

Kim Eklund, Antti J. Karttunen 2025 Physical Chemistry Chemical Physics

Tetrahedral Cu(I) Complexes for Thermally Activated Delayed Fluorescence: A Density Functional Benchmark Study with QM/MM Models

Toni Eskelinen, Antti J. Karttunen 2025 Inorganic Chemistry

Icosahedral Clusters [In@Tr₁₂]^10–:Synthesis, Characterization, and Electronic Structure Investigations of Na₄A₆Tr₁₃ (A = Rb, Cs; Tr = In, Tl)

Melissa Janesch, Antti J. Karttunen, Stefanie Gärtner 2025 European Journal of Inorganic Chemistry

Mono-, Di-, and Trinuclear Complex Anions of RuF₅ in Rb[RuF₆], Cs[Ru₂F₁₁], and [O₂][Ru₃F₁₆]

Björn Koch, Tim Graubner, Antti J. Karttunen, Florian Kraus 2025 European Journal of Inorganic Chemistry

Structure prediction of mixed-anion perovskites: systematic approach integrating octahedral tilting and anion ordering

Sanni Määttänen, Antti J. Karttunen 2025 Dalton Transactions

The Crystal Structure of Anhydrous [NMe₄]F

Martin Möbs, Antti J. Karttunen, Florian Kraus 2025 Zeitschrift fur Anorganische und Allgemeine Chemie

Organic Room-Temperature near-IR Phosphorescence Harvested by Intramolecular Through-Space Sensitization in Composite Molecules

Iida Partanen, Chao-Hsien Hsu, Emily Hsue-Chi Shi, Iván Maisuls, Toni Eskelinen, Antti J. Karttunen, Jarkko J. Saarinen, Cristian A. Strassert, Andrey Belyaev, Pi-Tai Chou, Igor O. Koshevoy 2025 Angewandte Chemie - International Edition