Locum Density Functional Theory Jobs (NOW HIRING)

Experience performing density functional theory calculations using VASP . * Strong background in atomistic modeling of crystalline materials, minerals, ceramics, metals, or solid-state materials.

The successful candidate will achieve this objective through the application of density functional theory (DFT) modeling of these processes using ab initio molecular dynamics (MD), and the ...

Research will include developing ion mobility - mass spectrometry techniques and analysis, density functional theory modeling, and preparation of conference presentations and research articles.

Research will include developing ion mobility - mass spectrometry techniques and analysis, density functional theory modeling, and preparation of conference presentations and research articles.

The successful candidate will achieve this objective through the application of density functional theory (DFT) modeling of these processes using ab initio molecular dynamics (MD), and the ...

Prior experience with density functional theory (DFT), ab initio molecular dynamics (AIMD), or machine learning interatomic potentials (MLIPs). * A solid conceptual background in electrochemistry.

... like density-functional theory, developing interatomic potentials with various methodologies including machine learning approaches, and performing coarse-graining to obtain effective models at ...

... density functional theory) computational tools. • High performance computing (e.g. slurm or other workload managers). • Applicants must be legally authorized to work in the United States on a ...

Density Functional Theory (DFT), machine-learned force fields (MLFF), graph neural networks (GNNs), or large language models (LLMs). Extensive Knowledge In: * First-principles simulations with ...

In-depth knowledge and hands-on experience with quantum chemical (QC) methods, including semi-empirical and density functional theory (DFT) approaches, molecular dynamics (MD) simulations, including ...

In-depth knowledge and hands-on experience with quantum chemical (QC) methods, including semi-empirical and density functional theory (DFT) approaches, molecular dynamics (MD) simulations, including ...

In-depth knowledge and hands-on experience with quantum chemical (QC) methods, including semi-empirical and density functional theory (DFT) approaches, molecular dynamics (MD) simulations, including ...

In-depth knowledge and hands-on experience with quantum chemical (QC) methods, including semi-empirical and density functional theory (DFT) approaches, molecular dynamics (MD) simulations, including ...

In this role you will simulate how our materials behave at the atomic and molecular scale, using methods such as density functional theory, molecular dynamics, and finite-element modeling. Because ...

In this role you will simulate how our materials behave at the atomic and molecular scale, using methods such as density functional theory, molecular dynamics, and finite-element modeling. Because ...

In-depth knowledge and hands-on experience with quantum chemical (QC) methods, including semi-empirical and density functional theory (DFT) approaches, molecular dynamics (MD) simulations, including ...

In-depth knowledge and hands-on experience with quantum chemical (QC) methods, including semi-empirical and density functional theory (DFT) approaches, molecular dynamics (MD) simulations, including ...

In-depth knowledge and hands-on experience with quantum chemical (QC) methods, including semi-empirical and density functional theory (DFT) approaches, molecular dynamics (MD) simulations, including ...

Conduct and oversee DFT (Density Functional Theory), MD (Molecular Dynamics), and QM (Quantum Mechanics) simulations of battery components, including electrolytes, coatings, and electrodes. * Develop ...

In-depth knowledge and hands-on experience with quantum chemical (QC) methods, including semi-empirical and density functional theory (DFT) approaches, molecular dynamics (MD) simulations, including ...