Prof. Dr. Christopher Künneth
Computational Materials Science
Ausgewählte Publikationen
2023
Leiske, Meike N.; Künneth, Christopher; De Breuck, Jonas; De Geest, Bruno G.; Hoogenboom, Richard
Amphiphilic Zwitterionic Bioderived Block Copolymers from Glutamic Acid and Cholesterol : Abili ...
In: Macromolecular Chemistry and Physics Bd. 224 (2023) Heft 24
doi:10.15495/EPub_UBT_00007314 ...
Shetty, Pranav; Rajan, Arunkumar Chitteth; Künneth, Christopher; Gupta, Sonakshi; Panchumarti, Lakshmi Prerana; Holm, Lauren; Zhang, Chao; Ramprasad, Rampi
A general-purpose material property data extraction pipeline from large polymer corpora using n ...
In: npj Computational Materials Bd. 9 (2023) Heft 1
doi:10.1038/s41524-023-01003-w ...
Gurnani, Rishi; Künneth, Christopher; Toland, Aubrey; Ramprasad, Rampi
Polymer Informatics at Scale with Multitask Graph Neural Networks
In: Chemistry of Materials Bd. 35 (2023) Heft 4. - S. 1560-1567
doi:10.1021/acs.chemmater.2c02991 ...
Shukla, Shivank S.; Künneth, Christopher; Ramprasad, Rampi
Polymer Informatics Beyond Homopolymers
arXiv, 2023
doi:10.48550/arXiv.2303.12938 ...
2022
Künneth, Christopher; Lalonde, Jessica; Marrone, Babetta L.; Iverson, Carl N.; Ramprasad, Rampi; Pilania, Ghanshyam
Bioplastic design using multitask deep neural networks
In: Communications Materials Bd. 3 (2022) Heft 1
doi:10.1038/s43246-022-00319-2 ...
Azevedo Antunes, Luis; Ganser, Richard; Künneth, Christopher; Kersch, Alfred
Characteristics of Low‐Energy Phases of Hafnia and Zirconia from Density Functional Theory Calc ...
In: Physica Status Solidi Rapid Research Letters Bd. 16 (2022) Heft 10
doi:10.1002/pssr.202100636 ...
Künneth, Christopher; Ramprasad, Rampi
polyBERT : A chemical language model to enable fully machine-driven ultrafast polymer informati ...
arXiv, 2022
doi:10.48550/arXiv.2209.14803 ...
2021
Künneth, Christopher; Schertzer, William; Ramprasad, Rampi
Copolymer Informatics with Multitask Deep Neural Networks
In: Macromolecules Bd. 54 (2021) Heft 13. - S. 5957-5961
doi:10.1021/acs.macromol.1c00728 ...
Künneth, Christopher; Schertzer, William; Ramprasad, Rampi
Correction to "Copolymer Informatics with Multitask Deep Neural Networks"
In: Macromolecules Bd. 54 (2021) Heft 15. - S. 7321
doi:10.1021/acs.macromol.1c01539 ...
Rajan, Arunkumar; Kim, Chiho; Künneth, Christopher; Kamal, Deepak; Gurnani, Rishi; Batra, Rohit; Ramprasad, Rampi
A massive dataset of synthesis-friendly hypothetical polymers
In: Bulletin of the American Physical Society Bd. 66 (2021) Heft 1
APS March Meeting 2021, Virtual
Chen, Lihua; Pilania, Ghanshyam; Batra, Rohit; Huan, Tran Doan; Kim, Chiho; Künneth, Christopher; Ramprasad, Rampi
Polymer informatics : Current status and critical next steps
In: Materials Science and Engineering: R: Reports Bd. 144 (2021)
doi:10.1016/j.mser.2020.100595 ...
Künneth, Christopher; Rajan, Arunkumar Chitteth; Tran, Huan; Chen, Lihua; Kim, Chiho; Ramprasad, Rampi
Polymer informatics with multi-task learning
In: Patterns Bd. 2 (2021) Heft 4
doi:10.1016/j.patter.2021.100238 ...
2020
del Rio, Beatriz G.; Künneth, Christopher; Tran, Huan Doan; Ramprasad, Rampi
An Efficient Deep Learning Scheme To Predict the Electronic Structure of Materials and Molecule ...
In: The Journal of Physical Chemistry A Bd. 124 (2020) Heft 45. - S. 9496-9502
doi:10.1021/acs.jpca.0c07458 ...
Künneth, Christopher; Ramprasad, Ramamurthy
Neural Network Based Molecular Dynamics to Study Polymers
In: Bulletin of the American Physical Society Bd. 65 (2020) Heft 1
APS March Meeting 2020, Denver, Colorado
Tran, Huan; Chen, Lihua; Pilania, Ghanshyam; Batra, Rohit; Kim, Chiho; Künneth, Christopher; Ramprasad, Rampi
Polymer Informatics : Current Status & Critical Next Steps
2020
2020 Virtual AIChE Annual Meeting,
2019
Schenk, Tony; Fancher, Chris M.; Park, Min Hyuk; Richter, Claudia; Künneth, Christopher; Kersch, Alfred; Jones, Jacob L.; Mikolajick, Thomas; Schroeder, Uwe
On the Origin of the Large Remanent Polarization in La:HfO₂
In: Advanced Electronic Materials Bd. 5 (2019) Heft 12
doi:10.1002/aelm.201900303 ...
Künneth, Christopher; Batra, Rohit; Rossetti Jr., George A.; Ramprasad, Rampi; Kersch, Alfred
Thermodynamics of Phase Stability and Ferroelectricity From First Principles
Ferroelectricity in Doped Hafnium Oxide: Materials, Properties and Devices
Duxford : Woodhead Publishing, 2019. - S. 245-289
doi:10.1016/B978-0-08-102430-0.00006-1 ...
2018
Materlik, Robin; Künneth, Christopher; Falkowski, Max; Mikolajick, Thomas; Kersch, Alfred
Al-, Y-, and La-doping effects favoring intrinsic and field induced ferroelectricity in HfO₂ : ...
In: Journal of Applied Physics Bd. 123 (2018) Heft 16
doi:10.1063/1.5021746 ...
Künneth, Christopher; Materlik, Robin; Falkowski, Max; Kersch, Alfred
Impact of Four-Valent Doping on the Crystallographic Phase Formation for Ferroelectric HfO₂ fro ...
In: ACS Applied Nano Materials Bd. 1 (2018) Heft 1. - S. 254-264
doi:10.1021/acsanm.7b00124 ...
Künneth, Christopher
Modeling the Ferroelectric and Pyroelectric Characteristics in Polycrystalline Doped Hafnium Di ...
München, 2018. - 106 S.
https://mediatum.ub.tum.de/?id=1440300
(Dissertation, 2018,
)
Kovac, Nicola; Künneth, Christopher; Alt, Hans Christian
Piezospectroscopy and first-principles calculations of the nitrogen-vacancy center in gallium a ...
In: Journal of Applied Physics Bd. 123 (2018) Heft 16
doi:10.1063/1.5011302 ...
Kersch, Alfred; Materlik, Robin; Künneth, Christopher; Falkowski, Max
Stabilization of ferroelectric properties in Hafnia with doping
High Performance Computing in Science and Engineering : Garching/Munich 2018
München : Bayerische Akademie der Wissenschaften, 2018. - S. 78-79
https://elib.dlr.de/121636/1/2018_SuperMUC-Results ...
Künneth, Christopher; Kölbl, Simon; Wagner, Hans Edwin; Häublein, Volker; Kersch, Alfred; Alt, Hans Christian
Symmetry and structure of carbon-nitrogen complexes in gallium arsenide from infrared spectrosc ...
In: Journal of Applied Physics Bd. 123 (2018) Heft 16
doi:10.1063/1.5006429 ...
Falkowski, Max; Künneth, Christopher; Materlik, Robin; Kersch, Alfred
Unexpectedly large energy variations from dopant interactions in ferroelectric HfO₂ from high-t ...
In: npj Computational Materials Bd. 4 (2018) Heft 1
doi:10.1038/s41524-018-0133-4 ...
2017
Pešić, Milan; Künneth, Christopher; Hoffmann, Michael; Mulaosmanovic, Halid; Müller, Stefan; Breyer, Evelyn T.; Schroeder, Uwe; Kersch, Alfred; Mikolajick, Thomas; Slesazeck, Stefan
A computational study of hafnia-based ferroelectric memories : from ab initio via physical mode ...
In: Journal of Computational Electronics Bd. 16 (2017) Heft 4. - S. 1236-1256
doi:10.1007/s10825-017-1053-0 ...
Fengler, Franz. P. G.; Pešić, Milan; Starschich, Sergej; Schneller, Theodor; Künneth, Christopher; Böttger, Ulrich; Mulaosmanovic, Halid; Schenk, Tony; Park, Min Hyuk; Nigon, Robin; Muralt, Paul; Mikolajick, Thomas; Schroeder, Uwe
Domain Pinning : Comparison of Hafnia and PZT Based Ferroelectrics
In: Advanced Electronic Materials Bd. 3 (2017) Heft 4
doi:10.1002/aelm.201600505 ...
Materlik, Robin; Künneth, Christopher; Mikolajick, Thomas; Kersch, Alfred
The impact of charge compensated and uncompensated strontium defects on the stabilization of th ...
In: Applied Physics Letters Bd. 111 (2017) Heft 8
doi:10.1063/1.4993110 ...
Künneth, Christopher; Materlik, Robin; Kersch, Alfred
Modeling ferroelectric film properties and size effects from tetragonal interlayer in Hf₁₋ₓZrₓO ...
In: Journal of Applied Physics Bd. 121 (2017) Heft 20
doi:10.1063/1.4983811 ...
2016
Schroeder, U.; Pešic, M.; Schenk, T.; Mulaosmanovic, H.; Slesazeck, S.; Ocker, J.; Richter, C.; Yurchuk, E.; Khullar, K.; Müller, J.; Polakowski, P.; Grimley, E. D.; LeBeau, J. M.; Flachowsky, S.; Jansen, S.; Kolodinski, S.; van Bentum, R.; Kersch, A.; Künneth, Christopher; Mikolajick, T.
Impact of field cycling on HfO₂ based non-volatile memory devices
2016 46th European Solid-State Device Research Conference (ESSDERC)
Lausanne , 2016. - S. 364-368
doi:10.1109/ESSDERC.2016.7599662 ...
2015
Mulaosmanovic, H.; Slesazeck, S.; Ocker, J.; Pesic, M.; Muller, S.; Flachowsky, S.; Müller, J.; Polakowski, P.; Paul, J.; Jansen, S.; Kolodinski, S.; Richter, C.; Piontek, S.; Schenk, T.; Kersch, A.; Künneth, Christopher; van Bentum, R.; Schroder, U.; Mikolajick, T.
Evidence of single domain switching in hafnium oxide based FeFETs : Enabler for multi-level FeF ...
2015 IEEE International Electron Devices Meeting (IEDM)
Washington, DC , 2015
doi:10.1109/IEDM.2015.7409777 ...
Hoffmann, Michael; Schroeder, Uwe; Künneth, Christopher; Kersch, Alfred; Starschich, Sergej; Böttger, Ulrich; Mikolajick, Thomas
Ferroelectric phase transitions in nanoscale HfO₂ films enable giant pyroelectric energy conver ...
In: Nano Energy Bd. 18 (2015) . - S. 154-164
doi:10.1016/j.nanoen.2015.10.005 ...
Materlik, R.; Künneth, Christopher; Kersch, A.
The origin of ferroelectricity in Hf₁₋ₓZrₓO₂ : A computational investigation and a surface ener ...
In: Journal of Applied Physics Bd. 117 (2015) Heft 13
doi:10.1063/1.4916707 ...
Computational Materials Science
Prof. Dr. Christopher Künneth
Universität Bayreuth
Universitätsstraße 30
95447 Bayreuth
Telefon: +49 (0)921 / 55 7330
E-Mail: christopher.kuenneth@uni-bayreuth.de
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