Senior Software Engineer – Accelerated Quantum Chemistry and cuEST

$184k - $357k • US, CA, Remote

Posted 1d ago

Job Location

US, CA, Remote

Tech Stack

Remote Work Policy

On-site

Categories

Machine Learning Engineer

About the job

NVIDIA is seeking a senior software engineer to accelerate quantum chemistry on NVIDIA GPUs with cuEST, a CUDA-X math library. This role involves expanding the frontiers of electronic structure theory for applications like drug discovery and semiconductor development. You will be involved in the day-to-day engineering of high-performance math libraries and innovating new algorithms to enhance practical quantum chemistry.

Responsibilities

  • Own the entire engineering mission of cuEST, from concept to a shipped CUDA-X library.
  • Architect, implement, optimize, productize, and deploy production-grade GPU solutions for quantum chemistry library primitives.
  • Provide technical leadership for specific code modules and contribute to team engineering projects.
  • Collaborate with engineering, product, and program teams to bring developed products to market.
  • Engage with the quantum chemistry community to drive adoption of GPU-accelerated quantum chemistry and incorporate new field developments.

Requirements

  • 10+ years of experience developing high-performance numerical methods for scientific computing.
  • 5+ years of experience developing production-grade quantum chemistry packages.
  • PhD or equivalent experience in computational physics, computational chemistry, computer science, or related technical fields.
  • Expert knowledge of GPU software development and performance optimization.
  • Proficiency in C++, CUDA, and common quantum chemistry tools.
  • Familiarity with lean team-based software engineering and agentic AI for software development.

Benefits

  • Equity
  • Benefits

About nvidia

Get new AI jobs in your inbox

A weekly digest of the newest AI engineering roles.

© 2026 AI Job Board. All rights reserved.