PhD and Postdoctoral Researcher in AI-Driven Platform for 2D Materials Synthesis and Discovery Paul Drude Institute for Solid State Electronics in Germany

Los Alamos National Laboratory’s Quantum and Condensed Matter Physics Group in the Theoretical Division is hiring a postdoctoral researcher in computational materials physics . The project centers on first-principles density functional theory (DFT) , high-throughput materials discovery , and machine learning for the discovery and inverse design of novel 2D f-electron materials with non-trivial topological properties . The work includes developing computational workflows and applying existing DFT...

University of Wisconsin-Madison is seeking a postdoctoral researcher in the group of Ying Li (Associate Professor) to work on machine-learned interatomic potentials (MLIPs) for hybrid organic–inorganic perovskites (HOIPs) . The project combines MLIPs , density-functional theory (DFT) , molecular dynamics , and machine learning to study finite-temperature phase behavior , structural dynamics , and electromechanical properties . The post mentions that the work builds on recent DFT–ML research on p...

Dr. Tao Wei at the University of South Carolina has immediate openings for a postdoc and a PhD student in materials simulations and machine learning . This opportunity is a good fit for applicants with interests in computational materials science , data-driven modeling, and related research at the intersection of materials science , computer science , and possibly physics . How to apply: interested applicants should first send a CV by email to Dr. Tao Wei at [email protected] . No deadline, st...

Monash University is advertising a double PhD degree opportunity with the University of Bayreuth for a project on accelerating organic semiconductor discovery with generative AI, molecular dynamics, and density functional theory (DFT) . The research sits at the intersection of materials science , computational chemistry , scientific machine learning , and physics , with a focus on designing next-generation organic semiconductor materials with tailored optoelectronic properties. The program is pa...

The PACE Lab (Predictive Atomistic Computations for Electrochemistry) in the Department of Mechanical Engineering at The University of Tennessee at Chattanooga is recruiting for two opportunities: a Postdoctoral Researcher and a funded M.S. position . The postdoctoral project focuses on machine learning interatomic potentials (MLIPs) for electrochemistry , with applications to electrochemical interfaces and energy materials . Strong candidates will have experience in DFT , molecular dynamics , m...