2 papers
cond-mat.mtrl-sci2024
Accounting for the Quantum Capacitance of Graphite in Constant Potential Molecular Dynamics Simulations
Kateryna Goloviznina, Johann Fleischhaker, Tobias Binninger +6
Molecular dynamics simulations at a constant electric potential are an essential tool to study electrochemical processes, providing microscopic information on the structural, therm…
cs.DC2015
Desktop to Cloud Migration of Scientific Computing Experiments
Satish Narayana Srirama, Pelle Jakovits, Vladislav Ivaništšev
Scientific computing applications usually need huge amounts of computational power. The cloud provides interesting high-performance computing solutions, with its promise of virtual…