Remote ML Materials Researcher for Predictive Discovery

IXO Inc.; France; Remote; EUR 3,600 - 8,900; Full time

Job summary

IXO Inc. seeks a collaborator to develop predictive models and reproducible workflows for computational materials research.

You will apply ML to material discovery and property prediction, training and evaluating models with DFT, MD, or Monte Carlo outputs, and integrating them into high-throughput pipelines. The role requires a strong ML and materials science background, a master’s or PhD, and the ability to solve problems independently.

Qualifications

• Peer-reviewed publication
• Expertise in ML and computational materials science
• Graduate qualification at master’s or doctoral level
• Independent technical problem-solving ability

Responsibilities

• Develop predictive ML models for material discovery and property prediction
• Train and evaluate models using DFT, MD or Monte Carlo outputs
• Integrate approaches into high-throughput materials pipelines
• Explain modeling assumptions and document reproducible methods

Skills

ML for materials

DFT/atomistic simulations

Graph neural networks

Python

Education

Master’s or PhD in materials science or related field

Tools

VASP

Quantum ESPRESSO

LAMMPS

ASE

Job description

IXO Inc. seeks a collaborator to develop predictive models and reproducible workflows for computational materials research.

You will apply ML to material discovery and property prediction, training and evaluating models with DFT, MD, or Monte Carlo outputs, and integrating them into high-throughput pipelines. The role requires a strong ML and materials science background, a master’s or PhD, and the ability to solve problems independently.