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Theoretical Chemistry Jobs (NOW HIRING)

1910

Computational Theoretical Chemist III

Boston, MA · On-site

  • PTO

Own computational chemistry programs across therapeutic modalities, disease targets, and ... Manage day-to-day operations of the Computational Theoretical Chemistry Team, mentor junior staff ...

1910

Computational Theoretical Chemist I

Boston, MA

Own computational theoretical chemistry programs across therapeutic modalities, disease targets, and indications * Ensure effective collaboration with the Biology, and Medicinal Chemistry teams by ...

1910

Computational Theoretical Chemist I

Boston, MA · On-site

  • PTO

Own computational theoretical chemistry programs across therapeutic modalities, disease targets, and indications * Ensure effective collaboration with the Biology, and Medicinal Chemistry teams by ...

1910

Computational Theoretical Chemist I

Boston, MA

Own computational theoretical chemistry programs across therapeutic modalities, disease targets, and indications * Ensure effective collaboration with the Biology, and Medicinal Chemistry teams by ...

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How much do theoretical chemistry jobs pay per year?

As of Aug 17, 2026, the average yearly pay for theoretical chemistry in the United States is $44,606.00, according to ZipRecruiter salary data. Most workers in this role earn between $28,000.00 and $57,500.00 per year, depending on experience, location, and employer.

What does a theoretical chemist do?

A theoretical chemist uses mathematical models, simulations, and computational techniques to understand chemical structures, reactions, and properties. They develop theories to explain molecular behavior and predict chemical outcomes, often working alongside experimental chemists. Their work has applications in drug design, materials science, and energy research, among other fields.

What are the key skills and qualifications needed to thrive in theoretical chemistry?

To thrive in Theoretical Chemistry, you need a strong background in chemistry, physics, advanced mathematics, and typically a Ph.D. in chemistry or a related field. Experience with computational modeling software (such as Gaussian or VASP), programming languages (like Python or Fortran), and familiarity with high-performance computing environments are crucial. Outstanding analytical thinking, attention to detail, and the ability to communicate complex ideas clearly make candidates stand out. These skills and qualities enable theoretical chemists to develop and interpret sophisticated models, collaborate with experimental teams, and contribute valuable insights to scientific research.

What are some common challenges faced in a theoretical chemistry role?

One common challenge in Theoretical Chemistry is dealing with the high complexity of mathematical models and ensuring that computational simulations accurately reflect real-world chemical processes. Theoretical chemists must stay current with rapidly evolving software and technology while managing large data sets and computational demands. Collaboration with experimental chemists is often required to validate theories and interpret findings, which necessitates strong interdisciplinary communication skills. Additionally, balancing research, publication, and occasional teaching or mentoring responsibilities is typical in academic or research-focused environments.

How do you become a theoretical chemist?

To become a theoretical chemist, one typically needs a bachelor's degree in chemistry, physics, or a related field, followed by a master's or Ph.D. in theoretical or computational chemistry. Developing strong skills in mathematics, computer programming, and using specialized software is essential for conducting research and simulations in this field.

How much does a theoretical chemist make?

Theoretical chemists typically earn a median annual salary of around $80,000 to $110,000, depending on experience, education, and location. Advanced roles or those in industry may offer higher compensation, especially for those with specialized skills in computational modeling and quantum chemistry.
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Infographic showing various Theoretical Chemistry job openings in the United States as of August 2026, with employment types broken down into 17% Internship, and 83% Full Time. Highlights an 100% In-person job distribution, with an average salary of $44,606 per year, or $21.4 per hour.

Associate or Full Professor - Computational/Theoretical Chemistry

Johns Hopkins University

Baltimore, MD • On-site

Full-time

Re-posted 11 days ago

Johns Hopkins University rating

8.0

Company rating: 8.0 out of 10

Based on 71 frontline employees who took The Breakroom Quiz

188th of 618 rated colleges and universities

Job description

Description
The Department of Chemistry at Johns Hopkins University (www.chemistry.jhu.edu) invites applications from outstanding candidates for a tenured position in the area broadly defined as computational/theoretical chemistry. We anticipate a start date between July 1, 2026 - July 1, 2027.
Qualifications
Applicants must hold a Ph.D. in Chemistry or a closely related field and have an established, externally funded, and internationally recognized research program along with demonstrated excellence in teaching and mentoring.
Application Instructions
Please direct questions to the search committee chair, Rigoberto Hernandez (r.hernandez@jhu.edu), or the department chair, Tim Warren (thw@jhu.edu).
Applicants should submit a curriculum vitae, a brief description of research plans, and a statement of teaching interests and philosophy through Interfolio at https://apply.interfolio.com/179786. Review of materials will begin March 1, 2026 and will continue until the appointment is finalized. Every effort will be made to ensure candidate confidentiality.

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About Johns Hopkins University

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Gilman believed that teaching and research go hand in hand—that success in one depends on success in the other—and that a modern university must do both well. He also believed that sharing our knowledge and discoveries would help make the world a better place. In 145 years, we haven’t strayed from that vision. This is still a destination for excellent, ambitious scholars and a world leader in teaching and research. Distinguished professors mentor students in the arts and music, humanities, social and natural sciences, engineering, international studies, education, business, and the health professions. Those same faculty members, along with their colleagues at the university’s Applied Physics Laboratory, have made us the nation’s leader in federal research and development funding every year since 1979. That’s a fitting distinction for America’s first research university, a place that has revolutionized higher education in the U.S. and continues to bring knowledge and discoveries to the world.

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Colleges, universities, and professional schools

Company size

10,000+ Employees

Headquarters location

Baltimore, MD, US

Year founded

1876

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