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Displaying 1 - 15 of 15
Bayesian Inferences of the Nuclear Equation of State
The dense matter equation of state (EOS), which describes the properties of matter at very high densities, plays a key ...
NaturwissenschaftenTeilchen, Kerne und Felder
Controlling the Aggregation of Phosphorescent alkynyl-Pt-NHC Complexes via Silyl-DED Substitution
Non-covalent interactions (NCIs) not only govern the structure biomacromolecules such as proteins and DNA, but often ...
NaturwissenschaftenPhysikalische und Theoretische Chemie
Defect chemistry and Band structure of NBT-xBT
Sodium bismuth titanate-barium titanate (Na0.5Bi0.5TiO3-BaTiO3, abbreviated as NBT- BT) with high Curie temperature and ...
NaturwissenschaftenChemische Festkörper- und Oberflächenforschung-
First-Principles Calculations of Spectroscopic Signatures III
Linking experimental and theoretical observations on a physical system is one of the key objectives of modern science ...
NaturwissenschaftenPhysik der kondensierten Materie 
GPU-Accelerated Solution of Many Small ODE Systems for High-Temperature Component Lifetime Modeling
Predicting the lifetime of components designed for very high temperatures is crucial for improving the efficiency and ...
IngenieurwissenschaftenMaterialwissenschaftInformatik
Noise-Sensitivity of Algorithms and Applications
In modern scientific research, HPC systems are irreplaceable for advancing knowledge across various fields. However, as ...
IngenieurwissenschaftenInformatik
Numerical Simulation of Nucleate Boiling in Microgravity
Nucleate boiling is a very efficient heat transfer mechanism. It is used in a wide variety of applications on Earth ...
IngenieurwissenschaftenWärmeenergietechnik, Thermische Maschinen, Strömungsmechanik
Practical Empirical Performance Modeling for CFD Applications using Extra-P
HPC applications can contain implicit performance bottlenecks, for example, due to caching or synchronization effects ...
IngenieurwissenschaftenInformatik
Computational Modeling of Biomolecules
The rational design and engineering of biomolecules can be support quite often by in silico investigations leveraging ...
IngenieurwissenschaftenInformatik-
Gluonic Green‘s Functions of Quantum Chromodynamics
According to modern physics, nature can be explained by four fundamental forces: the gravitational, the electromagnetic ...
NaturwissenschaftenTeilchen, Kerne und Felder 
Improvement of Methods for the Comparison of Protein Binding Sites
The detection of structural similarities between protein binding sites is an important challenge in medicinal drug ...
NaturwissenschaftenBiologische Chemie und Lebensmittelchemie
Modelling of Neutron Star Properties
The investigation of neutron stars is a central topic in modern astrophysics. Whereas the crust of the star consists of ...
NaturwissenschaftenAstrophysik und Astronomie
Orbital-Dependent Exchange-Correlation Energy Functionals
In this phase of the project the exact exchange (EXX) of density functional theory was applied to both free-standing ...
NaturwissenschaftenChemische Festkörper- und OberflächenforschungPhysikalische und Theoretische Chemie
Performance Measurement Techniques
In light of the complexity and diversity of current HPC platforms, programmers need to understand application execution ...
IngenieurwissenschaftenInformatik
Reynolds Number Effect on Turbulent Drag Reduction by Active Means
The control and manipulation of turbulent flows is an extremely important subject in the engineering practice. In ...
IngenieurwissenschaftenWärmeenergietechnik, Thermische Maschinen, Strömungsmechanik
