Peter Klein

Round Robin Study: Molecular Simulation of Thermodynamic Properties from Models with Internal Degrees of Freedom

Michael Schappals, Andreas Mecklenfeld, Leif C. Kröger et al. · Journal of Chemical Theory and Computation · 2017 · 74 citations

Engineering, Experimental Thermodynamics, Computational Chemistry +20

Multicriteria optimization of molecular force fields by Pareto approach

Katrin Stöbener, Peter Klein, Steffen Reiser et al. · Fluid Phase Equilibria · 2014 · 55 citations · Full text

Parametrization of two-center Lennard-Jones plus point-quadrupole force field models by multicriteria optimization

Katrin Stöbener, Peter Klein, Martin Horsch et al. · Fluid Phase Equilibria · 2015 · 51 citations

Numerical Analysis, Engineering, Pde-constrained Optimization +10

Sampling the Bulk Viscosity of Water with Molecular Dynamics Simulation in the Canonical Ensemble

René Hafner, Gabriela Guevara‐Carrion, Jadran Vrabec et al. · The Journal of Physical Chemistry B · 2022 · 33 citations · Full text

Engineering, Fluid Mechanics, Bulk Viscosity +16

The safety-bag expert system in the electronic railway interlocking system elektra

Peter Klein · Expert Systems with Applications · 1991 · 29 citations

Safety Engineering, Safety-critical System, Reliability Engineering +10