KFM 13: Materials for Storage and Conversion of Energy (joint session MM/KFM)
Tuesday, September 6, 2022, 10:15–11:30, H46
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10:15 |
KFM 13.1 |
How Important are Long-Range Electrostatics in Machine-Learning Potentials for Battery Materials? — •Carsten Staacke, Hendrik Heenen, Christoph Scheurer, Gabor Csanyi, Karsten Reuter, and Johannes Margraf
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10:30 |
KFM 13.2 |
Oxygen Hole Formation Controls Stability in LiNiO2 Cathodes: DFT Studies of Oxygen Loss and Singlet Oxygen Formation in Li-Ion Batteries — •Annalena Genreith-Schriever, Hrishit Banerjee, Clare P. Grey, and Andrew J. Morris
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10:45 |
KFM 13.3 |
Defects and Phase Formation in Non-Stoichiometric LaFeO3: A Combined Theoretical and Experimental Study — •Daniel Mutter, Roland Schierholz, Daniel Urban, Sabrina Heuer, Thorsten Ohlerth, Hans Kungl, Christian Elsässer, and Rüdiger-A. Eichel
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11:00 |
KFM 13.4 |
Can we improve thermoelectric properties by microstructural manipulations? — •Leonie Gomell, Tobias Haeger, Moritz Roscher, Hanna Bishara, Ralf Heiderhoff, Thomas Riedl, Christina Scheu, and Baptiste Gault
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11:15 |
KFM 13.5 |
Enhanced efficiency of graphene-silicon Schottky junction solar cell through inverted pyramid arrays texturation — •Jiajia Qiu, Huaping Zhao, Wenhui Ma, and Yong Lei
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