On-line Workshop
Computational Methods in Materials Science
Fundamentals and Applications
24-25 September 2021
Based in Warsaw and Poznań, POLAND
Accepted abstracts
- Yu. Hizhnyi, Taras Shevchenko National University of Kyiv, Kyiv, Ukraine, 2Institute of Physics, Polish Academy of Sciences Warsaw, Poland
Electronic structure of defects and band gap engineering in RAlO3 (R = Y, La, Gd, Yb, Lu) perovskites - M. Sharma, Otto Schott Institute of Materials Research, Friedrich-Schiller University of Jena, Jena, Germany Density functional embedding scheme for molecules and periodic systems coupled with wave function methods and real time-time dependent density functional theory
- G.D. Chaves-O'Flynn1, Institute of Molecular Physics, Polish Academy of Sciences, Poznań, Poland Topologically Informed Guesses in Chain uf States Methods to Calculate Thermal Activation Barriers in Micromagnetic Systems
