Sort by
Refine Your Search
-
rare-earth ions, with improved quality for optical, magneto-optical and laser applications. Different growth methods will be used such as Czochralski, Bridgman and Flux methods. Numerical modelling will
-
numerical calculations (DFT...) to achieve the objectives of the project. Develop adequat numerical methods necessary to reach these goals. Study of the Pt/Co/HfO2 interface: - Calculate the thermodynamical
-
metal dichaocogenides (TMDs) model the phononic bands of the host material with e.g. density functional theory (DFT) calculate the effect of a strain field on the electronic bands and the phonon modes
-
these effects in different solvents with molecules of different types: organic or inorganic, structure chirality or atropoisomeria. Main activities: This project is based on Optical Raman Activity (OAR
-
for three consecutive periods (2014-2018 and 2018-2022 and 2023-2026). ICN2 comprises 20 Research Groups, 7 Technical Development and Support Units and Facilities, and 2 Research Platforms, covering different
-
for the characterization of the different electronic populations in the heterostructure (effective mass, chemical potential, band bending) including the topological surface states, which is extremely difficult or impossible
-
an autonomous framework for setting up, executing, and optimizing complex electronic structure workflows, ranging from ground-state Density Functional Theory (DFT) to many-body perturbation theory methods such as
-
, or demonstrate a willingness to acquire relevant expertise rapidly. Proficiency in coding, numerical modeling, and experience with periodic DFT codes or MOLCAS are desirable attributes. The start date
-
heat transport at the nanoscale. Couple BTE-based models with information from atomistic simulations DFT of advanced materials and thermal interfaces. Investigate phonon scattering, thermal conductivity
-
will focus on the development of GPU-accelerated GPAW software based on density functional theory (DFT) for constant-potential calculations within a plane-wave framework. The developed software will be