Postdoc: Computational Inorganic Catalysis

Computational Chemistry List Home; Utah; On-site; USD 55,000 - 70,000; Full time

Job summary

Brigham Young University invites applications for a postdoctoral position in the Daniel Ess computational and simulation lab. The start date is anticipated between Jan 2027 and May 2027, with a deadline of Nov 30 for applications. Research will cover inorganic/organometallic reactions, catalysis, and collaborations with petrochemical partners.

Candidates should hold a Ph.D. in computational or theoretical chemistry, be independent, and excel in electronic structure programs, reaction mechanisms,

Qualifications

• PhD in computational or theoretical chemistry or related field.
• Strong background in reaction mechanisms.
• Programming skills (Python) with willingness to learn ML methods.

Responsibilities

• Model inorganic and organometallic reactions and catalysis.
• Perform electronic structure calculations and analyses.
• Apply machine learning techniques to chemical problems.
• Collaborate with industrial partners on catalyst design.

Skills

Python programming

Machine learning

Independent researcher

Education

PhD in computational/theoretical chemistry

Tools

Electronic structure software

Job description

Brigham Young University invites applications for a postdoctoral position in the Daniel Ess computational and simulation lab. The start date is anticipated between Jan 2027 and May 2027, with a deadline of Nov 30 for applications. Research will cover inorganic/organometallic reactions, catalysis, and collaborations with petrochemical partners.

Candidates should hold a Ph.D. in computational or theoretical chemistry, be independent, and excel in electronic structure programs, reaction mechanisms,