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preferred, but not required) are desired. Experiences with catalysis (biological, homogeneous, or heterogeneous), excited-state simulation methods, multiscale simulations (broadly defined), molecular dynamics
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to apply. We seek candidates with expertise in some or all the following areas: density functional theory, deep learning, high-throughput simulations, molecular dynamics, and materials chemistry. Strong
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theoretical models and numerical tools (master equations, quantum trajectory simulations) to investigate coupling regimes, dynamical phase transitions, and the effects of collective dissipation on coherence and
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is close. Our cohesive campuses make it easy to meet, work together and exchange knowledge, which promotes a dynamic and open culture. The ongoing societal transformation and large green investments in
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Join us to pioneer next-generation generative models that accelerate molecular dynamics. We seek a postdoctoral researcher to develop AI surrogates for molecular dynamics (MD), slashing
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correction, or many-body quantum systems. o Proficiency in numerical simulations (e.g., tensor networks, quantum circuit modeling). · For Experimentalists: o PhD in atomic/molecular/optical (AMO) physics
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Max Planck Institute for Extraterrestrial Physics, Garching | Garching an der Alz, Bayern | Germany | 22 days ago
dynamics simulations and enhanced sampling methods for the study of rare events, such as surface reactions and surface dynamics for astrophysically relevant conditions; simulating pure and mixed ices
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SUSMAT-RC - Postdoc Position in Computer-Aided Design and Discovery of Sustainable Polymer Materials
Computational Chemistry, Materials Science, or a related field. Strong background in computational chemistry techniques, including molecular dynamics, quantum mechanical simulations, and machine learning
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optimization code used, particularly for automated transition state searches. • Perform molecular dynamics simulations to estimate thermodynamic/macroscopic properties. IPREM brings together over 300 staff
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with surface science. Experience with molecular dynamics simulations and at least basic knowledge of machine-learning approaches for atomistic modeling are highly desirable. Skills in Python and