Projects
Hessian scientists of various disciplines are using High Performance Computers for their research.
Projects
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Projekte
Displaying 1 - 30 of 62
Calculating Reaction Energy Barrier of HCN Formation From CH2O With CuSSZ13 Zeolite Catalyst
Biomass-derived fuels are promising candidates to replace traditional fossil-based fuels for mobility and propulsion but ...
Engineering SciencesProcess Engineering, Technical Chemistry
Efficient Integration of Physically Enhanced Neural Networks in Particle-Resolved CFD Simulations of Industrial Packed-Bed Reactors
The investigation of novel or optimizing established processes is of paramount importance in chemical engineering in the ...
Engineering SciencesProcess Engineering, Technical Chemistry
Influence of Mixing Characteristics on Polymerization Reactors
The industrial production of high-density polyethylene (HDPE) through the catalytic polymerization of ethene is an ...
Engineering SciencesProcess Engineering, Technical Chemistry-
Investigation of the Phase Separation Process of Polymer-Monomer Mixtures II
The polymerization of low-density polyethylene takes place at high temperatures and pressures up to 3000 bar. Under ...
Engineering SciencesProcess Engineering, Technical Chemistry 
Large-Scale Configuration Interaction for Ab Initio Nuclear Structure III
The prime goal of ab initio (hyper)nuclear structure theory is the description of correlated systems of many baryons ...
Natural SciencesParticles, Nuclei and Fields
Quantification of Turbulent Coflow Effects on Liquid Fuel Atomization from a Pressure Swirl Atomizer
In response to the growing need for sustainable energy solutions and emission reduction, gas turbines offer a viable ...
Engineering SciencesProcess Engineering, Technical Chemistry-
Topological Susceptibility at High Temperatures from Lattice Quantum Chromodynamics II
Two unsolved problems in the standard model of particle physics are the strong CP-problem and the nature of dark matter ...
Natural SciencesParticles, Nuclei and Fields -
Topological Susceptibility at High Temperatures from Lattice Quantum Chromodynamics II
Two unsolved problems in the standard model of particle physics are the strong CP-problem and the nature of dark matter ...
NaturwissenschaftenTeilchen, Kerne und Felder 
An Agent-Based Model of Radiation-Induced Lung Fibrosis
Radiation-induced lung injuries such as pneumonitis and lung fibrosis (RILF) can lead to respiratory failure and ...
Natural SciencesStatistical Physics, Soft Matter, Biological Physics, Nonlinear Dynamics
Calculation on the Sphaleron Rate on 4D Lattices
Quantum Chromodynamics (QCD), sometimes referred to as the strong force, explains the forces that govern atomic nuclei ...
Natural SciencesParticles, Nuclei and Fields
Fully Open-Shell Medium-Mass Nuclei and Electromagnetic Observables for Ab Initio Nuclear Structure IV
The ab initio description of medium-mass nuclei is one of the most dynamic frontiers in nuclear structure theory. One ...
Natural SciencesParticles, Nuclei and Fields
Improved Nuclear Energy-Density Functionals from Local Chiral-Effective-Field-Theory Interactions
Nuclear energy density functionals successfully reproduce properties of nuclei across almost the entire nuclear chart ...
Natural SciencesParticles, Nuclei and Fields-
Investigation of the Phase Separation Process of Polymer-Monomer Mixtures
The low-density polyethylene polymerization process takes place at high pressure and temperatures. Knowledge of the ...
Engineering SciencesProcess Engineering, Technical Chemistry 
Large-Scale Configuration Interaction for Ab Initio Nuclear Structure II
The prime goal of ab initio nuclear structure theory is the description of correlated systems of many nucleons based on ...
Natural SciencesParticles, Nuclei and Fields
MD-Simulations to Study the Effect of Electric Fields on the SARS-CoV-2 Postfusion Structure
The interaction between the Spike (S) glycoprotein and the ACE2 receptor on the host cell constitutes the pivotal ...
Natural SciencesStatistical Physics, Soft Matter, Biological Physics, Nonlinear Dynamics
Modeling Soft and Biological Matter Systems
The project was majorly dedicated to build cell mechanistic models and study cell mechanics and cell migration. Both ...
Natural SciencesStatistical Physics, Soft Matter, Biological Physics, Nonlinear Dynamics
Numerical Bounds on Few Body Sector-Lengths
Analyzing the correlation structure of quantum systems is central to understanding their behaviour. The notion of sector ...
Natural SciencesParticles, Nuclei and FieldsEngineering SciencesComputer Science-
Precision Nuclear Structure Calculations with the In-Medium Similarity Renormalization Group
The structure of nuclei gives fundamental insight into strong interactions between nucleons, beyond-standard-model ...
Natural SciencesParticles, Nuclei and Fields 
RUBI Simulation (Numerical Simulations on the Effect of an Electric Field on Nucleate Boiling in Microgravity)
Nucleate boiling is a very efficient heat transfer mechanism. It is used in a wide variety of applications on Earth ...
Engineering SciencesProcess Engineering, Technical Chemistry-
Scientific Machine Learning for Chemical Kinetics
Detailed multi-scale modelling provides in-depth insights into the complex phenomena of catalytic systems that typically ...
Engineering SciencesProcess Engineering, Technical Chemistry 
Agent-Based Model of Radiation-Induced Lung Toxicity
Understanding the pathophysiology of lung fibrosis is of paramount importance to elaborate targeted and effective ...
Natural SciencesStatistical Physics, Soft Matter, Biological Physics, Nonlinear Dynamics
Fully Open-Shell Medium-Mass Nuclei and Electromagnetic Observables for Ab Initio Nuclear Structure III
The ab initio description of nuclear structure phenomena has progressed tremendously over the past years. In particular ...
Natural SciencesParticles, Nuclei and Fields
Influence of Mixing Processes on the Performance of High-Pressure Polymerization II
At industrial scale low-density polyethylene (LDPE) is produced at pressures up to 3000 bar in autoclave or tubular ...
Engineering SciencesProcess Engineering, Technical Chemistry
Investigation of Domain Switching Mechanics of Perovskite Ferroelectrics using Molecular Dynamics Simulations
Ferroelectric ceramics with perovskite structure can be used in novel cooling applications based on the electrocaloric ...
Engineering SciencesProcess Engineering, Technical ChemistryMaterials Science-
Matrix Elements of Next-Generation Chiral Interactions
The goal of ab initio nuclear structure theory is the description of nuclei from first principles without uncontrolled ...
Natural SciencesParticles, Nuclei and Fields 
Unraveling SARS-Cov-2 Spike Protein Conformational Dynamics Under the Influence of Electric Fields
The spike glycoprotein's interaction with the ACE2 receptor on the host cell is the crucial initial step for virus entry ...
Natural SciencesStatistical Physics, Soft Matter, Biological Physics, Nonlinear Dynamics
Ab Initio No-Core Shell Model
The prime goal of ab initio nuclear structure theory is the description of correlated systems of many nucleons based on ...
Natural SciencesParticles, Nuclei and Fields
Bayesian Inference of Cyclic Transcription Dynamics
Transcription is the process of converting DNA into RNA and is essential to cellular life. The transcription process ...
Natural SciencesStatistical Physics, Soft Matter, Biological Physics, Nonlinear Dynamics-
From RNA Sequence to Coarse-Grained Molecular Dynamics
The dynamics of large biomolecules such as proteins or RNAs provide an important insight into their function and ...
Natural SciencesStatistical Physics, Soft Matter, Biological Physics, Nonlinear Dynamics 
Fully Open-Shell Medium-Mass Nuclei and Electromagnetic Observables for Ab Initio Nuclear Structure II
The ab initio description of nuclear structure phenomena has progressed tremendously over the past years. In particular ...
Natural SciencesParticles, Nuclei and Fields
