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Christian Elsässer

Fraunhofer Society
Karlsruhe Institute of Technology

177

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4805

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Effect of Hydrogen in Mixed Gases on the Mechanical Properties of Steels—Theoretical Background and Review of Test Results

2021
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Efficient Modeling Workflow for Accurate Electronic Structures of Hybrid Perovskites

2021 Journal of Physical Chemistry C
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Localized Phonon Densities of States at Grain Boundaries in Silicon

2021 arXiv: Materials Science
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Influence of (N,H)-terminated surfaces on stability, hyperfine structure, and zero-field splitting of NV centers in diamond.

2021 arXiv: Materials Science
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Atomistic calculations of charged point defects at grain boundaries in SrTiO$_3$.

2021 arXiv: Materials Science
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First-principles calculation of electroacoustic properties of wurtzite (Al,Sc)N

2021 Physical Review B
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Stability and magnetic properties of grain boundaries in the inverse Heusler phase Fe$_2$CoGa and in bcc Fe

2021 arXiv: Materials Science
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Defects and phase formation in non-stoichiometric LaFeO$_3$: a combined theoretical and experimental study

2021 arXiv: Materials Science
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Wurtzite ScAlN, InAlN, and GaAlN crystals, a comparison of structural, elastic, dielectric, and piezoelectric properties

2021 Journal of Applied Physics
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Electrostatic treatment of charged interfaces in atomistic calculations

2021 arXiv: Materials Science
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