[Japan] Computational Chemistry Intern (Materials Modeling/Molecular Simulation)

Tasks

• Analyze structural dynamic and thermodynamic properties
• Build automated data processing pipelines
• Construct simulation systems and generate initial structures
• Convert outputs into reports visualizations and presentations
• Execute full molecular dynamics workflow
• Improve workflow robustness and reproducibility
• Monitor and troubleshoot simulation runs
• Perform molecular dynamics simulations for liquid phase systems
• Scale and engineer molecular simulation workflows
• Setup simulation parameters
• Submit simulation jobs and utilize HPC resources
• Support computational chemistry modeling and simulation of electrolyte systems

Perks/Benefits

• Remote work
• Training and mentorship

Skills/Tech-stack

Coordination Number | Diffusion Coefficient | Field development | Force Field | Force field development | Force field optimization | GROMACS | HPC Job Submission | Ion transport | Job monitoring | Job submission | LAMMPS | Molecular Dynamics | OpenMM | Python | Radial Distribution Function | Simulation Workflow | Simulation workflow automation | Solvation Structure | Statistical Analysis | Thermodynamic analysis | Troubleshooting | Workflow automation