Postdoctoral Researcher-MiCCoM

Argonne National Laboratory

Lemont, IL

Job posting number: #7072480 (Ref:409114)

Posted: November 23, 2020

Application Deadline: Open Until Filled

Job Description

The Midwest integrated center for computational materials (MICCoM, http://miccom-center.org) has an opening for one postdoctoral position at Argonne National Laboratory to develop codes to perform first principle molecular dynamics simulations and GW-BSE calculations on pre-exascale and exascale platforms. Candidates are sought with experience in the development of scientific software for high performance architectures and experience in coding on GPUs to support the development and deployment of Qbox (http://qboxcode.org) and WEST (http://www.west-code.org) onto accelerated heterogeneous architectures based on GPUs. The successful candidate will work in collaboration with code teams, library and tools developers, with frequent interactions with the Argonne Leadership Computing Facility (ALCF) and the National Energy Research Scientific Computing Center (NERSC). The postdoctoral researcher will be a part of a multidisciplinary team composed of computational and domain scientists, graduate students and post-doctoral research associates and will have the unique opportunity not only to enable the transition of electronic structure codes to exascale architecture, but also to participate in the use of these codes to tackle complex materials science problems with focus on materials for sustainability and quantum information science.

 Major duties and responsibilities:

  • Code porting for high performance architectures
  • Development of scientific workflows that leverage exascale resources
  • Debug/profile/optimization of software

Position Requirements Skills and Experience:

  • Experience with GPU and parallel/manycore computer architectures, threading, and vectorization
  • Proficient in C++, Fortran, Python
  • Experience with algorithm optimization and parallel programming (MPI, OpenMP)
  • Knowledge of software design, debugging/profiling tools
  • Ability to create, maintain, and support high-quality software using Git version-control system
  • Excellent communication skills both verbal and written
  • Considerable independent judgment and critical thinking
  • Ability to work in a team

Basic knowledge of Qbox and WEST is an advantage but is not required. Typical candidates will be independent, motivated and ambitious individuals with MSc or PhD in Materials Science, Computer Science, Physics, Chemistry or Chemical Engineering or with comparable skills and experience. They will be individuals motivated to work in an interdisciplinary team and with an interest to possibly transition into staff position over a short period.

As an equal employment opportunity and affirmative action employer, and in accordance with our core values of impact, safety, respect, integrity and teamwork, Argonne National Laboratory is committed to a diverse and inclusive workplace that fosters collaborative scientific discovery and innovation. In support of this commitment, Argonne encourages minorities, women, veterans and individuals with disabilities to apply for employment. Argonne considers all qualified applicants for employment without regard to age, ancestry, citizenship status, color, disability, gender, gender identity, genetic information, marital status, national origin, pregnancy, race, religion, sexual orientation, veteran status or any other characteristic protected by law.

Argonne employees, and certain guest researchers and contractors, are subject to particular restrictions related to participation in Foreign Government Talent Recruitment Programs, as defined and detailed in United States Department of Energy Order 486.1. You will be asked to disclose any such participation in the application phase for review by Argonne’s Legal Department.



Argonne is an equal opportunity employer, and we value diversity in our workforce. As an equal employment opportunity and affirmative action employer, Argonne National Laboratory is committed to a diverse and inclusive workplace that fosters collaborative scientific discovery and innovation. In support of this commitment, Argonne prohibits discrimination or harassment based on an individual's age, ancestry, citizenship status, color, disability, gender, gender identity, genetic information, marital status, national origin, pregnancy, race, religion, sexual orientation, veteran status or any other characteristic protected by law.


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Job posting number:#7072480 (Ref:409114)
Application Deadline:Open Until Filled
Employer Location:Argonne National Laboratory
Argonne,Illinois
United States
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