Projects Hessian scientists of various disciplines are using High Performance Computers for their research How to prepare a new research report?
ab initio calculations on the intrinsic Spin Hall effect The field of spintronics recently gained much interest because it promises faster, smaller and less energy consuming ... Theoretical Condensed Matter Physics
Adaptive Numerical Wavelet Frame Methods for Elliptic and Parabolic Operator Equations, Inverse Problems, and Stochastic Evolution Equations Many real-world phenomena are modelled by partial differential equations. Even in relatively low dimensions, the ... Mathematics
Computational Analysis of GPCR Biased Signaling G protein-coupled receptors (GPCRs) constitute a large family of membrane proteins which share a conserved structural ... Medicine
Cononsolvency in Aqueous Alcohols Solutions Smart polymers respond to environmental factors such as change in temperature, pH, or solvent. An example is the ... Physical and Theoretical Chemistry
Fast circularisation of Rydberg atoms Circular Rydberg states refer to the valence electron of a highly excited atom in a circular orbit. Due to their very ... Optics, Quantum Optics and Physics of Atoms, Molecules and Plasmas
Ground- and excited-state properties of substrate-supported nanowires calculated from first principles Ideal one-dimensional electronic systems are characterized by unusual and fascinating physical phenomena, including ... Theoretical Condensed Matter Physics
Metal/organic interfaces studied with Density Functional Theory Metal/organic interfaces are found in several technologies that are key to developing modern electronic devices. ... Chemical Solid State and Surface Research
NIR Excitation and Tunneling of Dihydroxycarbene While quantum-mechanical tunneling (QMT) was recognized early in the emerging field of quantum theory as an accelerating ... Molecular Chemistry
Pedestrian Detection Using Shearlets One main application area of pedestrian detection is located in the automotive domain. The usage of collusion warning ... Mathematics
Selective organic reactions enabled by isotope-controlled tunneling reactivity A large kinetic isotope effect (KIE) is one of the criteria that indicates quantum mechanical tunneling in a chemical ...
The role of dispersion in catalysis London dispersion (LD) interactions constitute the attractive part of the van-der-Waals potential and they have been ... Molecular Chemistry
Interface Phenomena in Battery Materials and Exchange Spring Magnets The project focused on interface phenomena in battery materials and exchange spring magnets but also studied the ... Materials Science Materials Engineering
Effect of Strain on Transport Properties in Solid Electrolytes Solid electrolytes (SE) in all-solid-state batteries due to their high safety and flexibility in design have attracted ... Chemical Solid State and Surface Research
ExaFSA - Exascale Simulation of Fluid-Structure-Acoustics Interactions The ExaFSA project aims to combine the two dominant trends in engineering simulations: multiphysics and high-performance ... Heat Energy Technology, Thermal Machines, Fluid Mechanics
Investigating the Switching Dynamics of an Ammonium-tagged Azobenzene in the Gas Phase and in Polar Solvents Our investigation aimed at determining the photo-physical properties of an ammonium tagged azobenzene 1 in comparison to ...
Investigations of the Flame Dynamics of a Side Wall Quenching Flame Since nearly 86% of the world wide energy demand is obtained through combustion, it is necessary to improve related ... Heat Energy Technology, Thermal Machines, Fluid Mechanics
Ion Conduction and Defect Formation in Sodium Bismuth Titanate Studied by Density Functional Theory Calculations Atomistic calculations enable us to observe processes on the micro scale, where common continuum mechanics are not valid ... Materials Science
Mercapto carbenes − New precursor strategies Schreiner’s group was able to synthesize various hydroxy carbenes by thermal extrusion of CO2 from α-keto carboxylic ...
Modelling of Nanoparticle Generation due to a Short Laser Pulse and Nanoparticle Ablation in Different Media This work is a successor of our previous study [1], were the mechanism of periodic nanostructuring process due to UV ... Theoretical Condensed Matter Physics
Analyzing, Comparing and Evaluating Non-Stationary Methods for Oxy-Fuel Configurations The separation of CO2 in oxy-coal combustions is facilitated through firing coal in oxygen (O2) enriched recirculated ... Heat Energy Technology, Thermal Machines, Fluid Mechanics
Simulation of Flow-Induced Noise and Vibration for Turbulent Flows The turbulent flow around blunt bodies induces aeroacoustic sources due to the interaction of the fluid with geometrical ... Heat Energy Technology, Thermal Machines, Fluid Mechanics
A Generic 3D-Diverse Fragment Library for Crystallographic Screening and Drug Discovery Ligand binding pockets differ regarding their shape and arrangement of potential interaction sites. Thus, we design a ... Chemical Solid State and Surface Research
Ab-initio Description of p-shell Hypernuclei Hypernuclei are atomic nuclei that contain other baryons apart from nucleons (protons and neutrons). These other baryons ... Particles, Nuclei and Fields
Ab-initio-Untersuchung von Zinnoxiden Zinnoxide mit verschiedenen Zusammensetzungen: Auf dem Weg zum elektronischen Bauelement Zinn ist ein ungiftiges ... Particles, Nuclei and Fields
Advanced Electro-Optical Modeling of III-Nitride Light Emitters As part of the research group POLARCON, we intend to study the active region carrier dynamics in III-nitride light ... Optics, Quantum Optics and Physics of Atoms, Molecules and Plasmas
Aktivitätsgetragene neuronale Repräsentation von Vorinformation in der visuellen Wahrnehmung Während der Wahrnehmung von visuellen Stimuli greifen wir ständig auf gespeicherte Informationen aus unserer bisherigen ... Neurosciences
ALICE Experiment - The Search for Signatures of the Quark-Gluon Plasma The group participates in the ALICE experiment at the Large Hadron Collider (LHC) at CERN. The research activities focus ... Optics, Quantum Optics and Physics of Atoms, Molecules and Plasmas
Andauernde Weiterentwicklung eines Frameworks für numerische Simulationen auf Basis von Discontinuous Galerkin-Methoden In den Ingenieurswissenschaften tritt eine Vielzahl von Problemstellungen auf, welche sich nur durch partielle ... Heat Energy Technology, Thermal Machines, Fluid Mechanics
Atomistic Computer Simulations of Amorphization in Metal/Metallic-Glass Multilayer Systems Metals show a strong tendency to form crystalline, i.e., ordered phases. For unalloyed metals, the thermodynamically ... Materials Science
Automatische Hardwaresynthese für Löser von konvexen Optimierungsproblemen Die konvexe Optimierung ist ein Teilgebiet der mathematischen Optimierung. Es gilt dabei eine bestimmte Größe ... Computer Science
