Job Description
Job Overview:
Position Title:
Postdoctoral Researcher in Machine Learning and Computational ChemistryAppointment Type:
Post Doc/TraineeJob Description:
Summary of Duties and Responsibilities:
The Postdoctoral Researcher will develop machine learning (ML)-based methods for reaction dynamics simulations in both gas-phase and condensed-phase systems. The primary focus of this position is the development and enhancement of reliable, robust ML-based reactive potentials to support advanced computational chemistry research.
In addition to conducting independent and collaborative research, the Postdoctoral Researcher will serve as a primary point of contact for an open-source software platform, providing technical support, guidance, and assistance to members of the scientific community. The successful candidate will contribute to software development, user engagement, and the dissemination of research findings through publications and presentations.
Required Minimum Qualifications:
PhD in Chemistry or a closely related field.
Preferred Qualifications:
- Demonstrated experience conducting quantum chemistry calculations and reaction dynamics simulations.
- Demonstrated experience developing Python-based software for direct dynamics applications.
- Demonstrated experience developing machine learning-based force fields for reactive dynamics simulations.
- Strong publication record in reputable, peer-reviewed scientific journals.
- Demonstrated ability to collaborate effectively with computational chemists on scientific software development projects.
- Demonstrated ability to collaborate effectively with experimental chemists in the simulation and interpretation of crossed-beam and guided-beam experiments.
Department/Program & College Description:
The Department of Chemistry at Iowa State University is proud to offer dynamic research opportunities in analytical and bioanalytical chemistry, inorganic and materials chemistry, organic and bioorganic chemistry, physical and theoretical chemistry, and chemical education. Located in Gilman Hall and Hach Hall on the ISU campus, our department is home to dedicated faculty, staff, graduate students, and cutting-edge research laboratories. We are committed to fostering a supportive and engaging environment that prioritizes both the academic success and personal well-being of our outstanding chemistry majors.
Department Unit/Website:
Department of Chemistry
Candidates must be legally authorized to work in the U.S. on an ongoing basis without sponsorship. Immigration sponsorship is not available for this position.
Application Instructions:
To apply for this position, please click on “Apply” and complete the Employment Application. Please be prepared to enter or attach the following:
Resume/Curriculum Vitae
Letter of Application/Cover Letter
Why Choose Iowa State University?
Iowa State Employees enjoy comprehensive health and work-life benefits, including medical and dental, as well as:
- Retirement benefits including defined benefit and defined contribution plans
- Generous vacation, holiday, and sick time and leave plans
- Onsite childcare (Ames, Iowa)
- Life insurance and long-term disability
- Flexible Spending Accounts
- Various voluntary benefits and discounts
- Employee Assistance Program
- Wellbeing program
- Iowa State offers WorkFlex options for some positions. WorkFlex offers flexibility on when, where, and how you do your work. For more information, please speak with the Hiring Manager.
If you have questions regarding this application process, please email employment@iastate.edu, or call 515-294-4800 or Toll Free: 1-877-477-7485.
Proposed Start Date:
September 1, 2026Number of Months Employed Per Year:
12 Month Work PeriodTime Type:
Full timePay Grade:
Post DocsOriginal Posting Date:
July 1, 2026Posting Close Date:
July 8, 2026Job Requisition Number:
R19556Iowa State University does not discriminate on the basis of race, color, age, ethnicity, religion, national origin, pregnancy, sexual orientation, genetic information, sex, marital status, disability, or status as a U.S. Veteran. Inquiries regarding non-discrimination policies may be directed to Office of Equal Opportunity, 2680 Beardshear Hall, 515 Morrill Road, Ames, Iowa 50011, Tel. 515-294-7612, email eooffice@iastate.edu.
General ISU compensation information can be found on the University Human Resources website. Please note that this is only a list of ranges and individuals will be paid commensurate with qualifications.
