Fraunhofer-Gesellschaft

Publica

Hier finden Sie wissenschaftliche Publikationen aus den Fraunhofer-Instituten.
2021Atomistic analysis of Li migration in Li1+xAlxTi2-x(PO4)3 (LATP) solid electrolytes
Pfalzgraf, D.; Mutter, D.; Urban, D.F.
Zeitschriftenaufsatz
2021Atomistic calculations of charged point defects at grain boundaries in SrTiO3
Tao, C.; Mutter, D.; Urban, D.F.; Elsässer, C.
Zeitschriftenaufsatz
2021First-principles calculations of phase stability, electronic structure, and defect properties of perovskites for SOFC/SOEC electrodes
Mutter, D.; Urban, D.F.; Elsässer, C.
Konferenzbeitrag
2020Berechnungen katalytisch relevanter Eigenschaften atomarer Defekte in Perowskit-Anodenmaterialien für Festoxid-Elektrolysezellen. Abschlussbericht V1036/2020
Mutter, D.; Urban, D.; Elsässer, C.
Bericht
2020Determination of formation energies and phase diagrams of transition metal oxides with DFT+U
Mutter, D.; Urban, D.F.; Elsässer, C.
Zeitschriftenaufsatz
2019Computational analysis of composition-structure-property-relationships in NZP-type materials for Li-ion batteries
Mutter, D; Uraban, F.; Elsässer, C.
Zeitschriftenaufsatz
2017Systematic search for lithium ion conducting compounds by screening of compositions combined with atomistic simulation
Mutter, D.; Urban, D.; Elsässer, C.
Zeitschriftenaufsatz
2016Computational analysis of Li diffusion in NZP-type materials by atomistic simulation and compositional screening
Mutter, D.; Lang, B.; Ziebarth, B.; Urban, D.; Elsässer, C.
Aufsatz in Buch