Company Description Join us and make YOUR mark on the World!Are you interested in joining some of the brightest talent in the world to strengthen the United States security?

We are looking for a highly motivated researcher with solid bresearch experience in mesoscale materials modelling to carry out meso-scale simulations of Li/Na dendrite growth in solid-state baterries, and to develop machine learning methods to assist multiscale modelling for zero-excess solid-state batteries.

The project will computationally investigate the properties of multi-principal elemental or high-entropy alloys. Such novel alloys, containing many elements in significant concentrations, have shown promising mechanical, high-temperature, and radiation-resistant properties. However, finding the optimal alloy compositions with a given set of suitable elements is far from trivial.

We have openings for Computational Materials and Chemical Research Scientists to conduct a full range of complex research in the areas of actinide process modeling. You will actively participate with and be an integral member of an interdisciplinary team responsible for modeling and simulation for actinide processing unit operations in support of the Nonproliferation Stewardship Program and other national security programs. These positions are in the Materials Science Division.

The Quantum Computational Science Group within the Quantum Information Science (QIS) Section is currently seeking applications for a senior research scientist in quantum computing software. Our QIS section focuses on foundational quantum theory and experiment in the areas of quantum computing, quantum networking, and quantum sensing.

Applicants must hold a Ph.D. in Physics, Materials Science, or Chemistry and have a track record in computational materials research at the density-functional theory level and beyond. The successful candidate will have a solid background in many-body electronic structure methods, prior experience with the development of electronic structure software, and an interest in advancing community software. Previous experience with electron-phonon physics and Fortran/MPI programming is expected.

Company Description Join us and make YOUR mark on the World!Are you interested in joining some of the brightest talent in the world to strengthen the United States security?

The Theory and Modeling group at the Center for Nanoscale Materials, Argonne National Laboratory, has immediate Research & Development Level 1 term staff opening in the area of computational materials modeling, AI/machine learning and data analysis of complex fluids. Specifically, the research involves development of AI and machine learning workflows and tools to understand critical phenomena in complex fluids.

We are seeking a Postdoctoral Research Associate who will support the Advanced Computing for Chemistry and Materials Group in the National Center for Computational Sciences (NCCS), Computing and Computational Sciences Directorate (CCSD) at Oak Ridge National Laboratory (ORNL) to perform leading-edge computational chemistry/materials research and development for applications in the energy sciences and biophysics.

Company Description Join us and make YOUR mark on the World!Are you interested in joining some of the brightest talent in the world to strengthen the United States security?

Company Description Join us and make YOUR mark on the World!Are you interested in joining some of the brightest talent in the world to strengthen the United States security?

The Theory and Modeling group at the Center for Nanoscale Materials, Argonne National Laboratory, has immediate Research & Development Level 1 term staff opening in the area of computational materials modeling, AI/machine learning and data analysis of complex fluids. Specifically, the research involves development of AI and machine learning workflows and tools to understand critical phenomena in complex fluids.

An entry level postdoc position requiring a Ph.D. is open for materials scientist and physicists of varying experience to work with an all-Ph.D staff of theoretical and computational physicists, mathematicians, applied and quantum chemists, and electrical engineers who are international experts in their respective fields.

The Hybrid Computational/Experimental Materials Scientist serves as a scientific subject matter expert on multidisciplinary project teams working to bring new medicines to market. They are responsible for defining the final drug substance form (salt / polymorph / hydrate) for active pharmaceutical ingredients (API) and for defining the preferred physical attributes (particle shape / particle size / surface energy). They also lead the development of new scientific strategies within the group and mentor colleagues in the drug development process.

Company Description Join us and make YOUR mark on the World!Are you interested in joining some of the brightest talent in the world to strengthen the United States security?

The Scanlon Materials Theory Group (SMTG), led by Professor David O. Scanlon is joining the School of Chemistry in September 2023. We are seeking to recruit a Research Fellow II (Senior Research Fellow, Grade 8) in Computational Materials Chemistry to serve as a Group Leader in the SMTG. The research areas the group is actively researching in are transparent conducting oxides, photovoltaics, batteries, thermoelectrics, photocatalysis and inorganic phosphors.

Requisition Id10532 Overview: We are seeking a Group Leader for the Advanced Computing for Chemistry and Materials group within the Science Engagement section in the National Center for Computational Sciences (NCCS).NCCS Provides state-of-the-art computational and data science infrastructure coupled with dedicated scientific and technical professionals tackling large-scale problems across a broad range of scientific domains for accelerating scientific discovery and engineering advances.

Our Simulation and Optimization (S&O) team is looking for an experienced computational chemist to join our Drug Discovery team. This person's responsibility will be to drive innovation by applying next generation methods to support drug discovery combining quantum, AI and physics-based methods like molecular dynamics and free energy perturbation. You will be joining a seasoned multi-disciplinary group including drug hunters with an excellent track record in drug discovery, computational chemists, physicists, AI experts, and software engineers. You are action orientated and extraordinary at getting things done. You communicate openly with your colleagues and you hate office politics.

Requisition Id10477 Overview: Oak Ridge National Laboratory is the largest US Department of Energy science and energy laboratory conducting basic and applied research to deliver transformative solutions to compelling problems in energy and security.We are seeking a Postdoctoral Research Associate who will support the Advanced Computing for Chemistry and Materials in the National Center for Computational Sciences (NCCS) Computing and Computational Sciences Directorate (CCSD) at Oak Ridge National Laboratory (ORNL) to perform leading-edge computational materials research and development.

Requisition Id10532 Overview: We are seeking a Group Leader for the Advanced Computing for Chemistry and Materials group within the Science Engagement section in the National Center for Computational Sciences (NCCS).NCCS Provides state-of-the-art computational and data science infrastructure coupled with dedicated scientific and technical professionals tackling large-scale problems across a broad range of scientific domains for accelerating scientific discovery and engineering advances.