... computational methods for analyzing them. Key job responsibilities We are looking to hire an ... chemistry, optimization, or machine learning - or develop entirely new algorithms - Perform ...
... computational methods for analyzing them. Key job responsibilities We are looking to hire an ... chemistry, optimization, or machine learning - or develop entirely new algorithms - Perform ...
Research Scientist, Computational Condensed Matter Physics
Cambridge, MA · On-site
$176K - $304K/yr
The focus is on using computational insight to identify promising materials, explain structure ... Deep understanding of electronic-structure theory (quantum chemistry, DFT, beyond-DFT methods, etc ...
Research Scientist, Computational Condensed Matter Physics
Cambridge, MA · On-site
$176K - $304K/yr
The focus is on using computational insight to identify promising materials, explain structure ... Deep understanding of electronic-structure theory (quantum chemistry, DFT, beyond-DFT methods, etc ...
Postdoctoral Appointee - AI-Driven Computational Catalysis
Lemont, IL · On-site
$72K - $121K/yr
The Chemical Sciences and Engineering Division invites applications for a Postdoctoral Appointee to contribute to innovative research at the intersection of computational catalysis, quantum chemistry ...
Postdoctoral Appointee - AI-Driven Computational Catalysis
Lemont, IL · On-site
$72K - $121K/yr
The Chemical Sciences and Engineering Division invites applications for a Postdoctoral Appointee to contribute to innovative research at the intersection of computational catalysis, quantum chemistry ...
Chemist with Python Proficiency - AI Trainer
Austin, TX · Remote
$51.50 - $71/hr
Working knowledge of one or more domain-specific computational chemistry tools, including but not limited to GROMACS, LAMMPS, PySCF, ORCA, xtb, CREST, Quantum ESPRESSO, phonopy, pymatgen, AutoDock ...
Quick apply
Chemist with Python Proficiency - AI Trainer
Austin, TX · Remote
$51.50 - $71/hr
Working knowledge of one or more domain-specific computational chemistry tools, including but not limited to GROMACS, LAMMPS, PySCF, ORCA, xtb, CREST, Quantum ESPRESSO, phonopy, pymatgen, AutoDock ...
Lecturer (in lieu of GSI) Pool - Molecular Science and Software Engineering (MSSE) - College of Chem
Berkeley, CA · On-site
$70K - $199K/yr
Computational Quantum Chemistry * Leadership, management, and entrepreneurship in a computational science company or organization General Duties Duties include assisting or leading lectures, leading ...
Lecturer (in lieu of GSI) Pool - Molecular Science and Software Engineering (MSSE) - College of Chem
Berkeley, CA · On-site
$70K - $199K/yr
Computational Quantum Chemistry * Leadership, management, and entrepreneurship in a computational science company or organization General Duties Duties include assisting or leading lectures, leading ...
Senior Quantum Computational Materials Scientist, US
Washington, DC · On-site
$120K - $175K/yr
... Quantum Computational Materials Scientist to join our team in Washington DC. In this newly created ... PhD in (ab initio) electronic structure methods, theory and computation, Chemistry, Physics ...
Quick apply
Senior Quantum Computational Materials Scientist, US
Washington, DC · On-site
$120K - $175K/yr
... Quantum Computational Materials Scientist to join our team in Washington DC. In this newly created ... PhD in (ab initio) electronic structure methods, theory and computation, Chemistry, Physics ...
... Quantum Computational Materials Scientist to join our team in Washington DC. In this newly created ... PhD in (ab initio) electronic structure methods, theory and computation, Chemistry, Physics ...
... Quantum Computational Materials Scientist to join our team in Washington DC. In this newly created ... PhD in (ab initio) electronic structure methods, theory and computation, Chemistry, Physics ...
Senior Quantum Computational Materials Scientist, US
Washington, DC · On-site
$120K - $175K/yr
... Quantum Computational Materials Scientist to join our team in Washington DC. In this newly created ... PhD in (ab initio) electronic structure methods, theory and computation, Chemistry, Physics ...
Senior Quantum Computational Materials Scientist, US
Washington, DC · On-site
$120K - $175K/yr
... Quantum Computational Materials Scientist to join our team in Washington DC. In this newly created ... PhD in (ab initio) electronic structure methods, theory and computation, Chemistry, Physics ...
Senior Scientist I Computational Chemistry
North Chicago, IL · On-site
$96K/yr
Knowledge in one or more areas of the computational chemistry discipline, such as quantum mechanics ... chemistry, molecular reactivity, molecular dynamics, structure-based design, ligand-based design ...
Senior Scientist I Computational Chemistry
North Chicago, IL · On-site
$96K/yr
Knowledge in one or more areas of the computational chemistry discipline, such as quantum mechanics ... chemistry, molecular reactivity, molecular dynamics, structure-based design, ligand-based design ...
Senior Scientist I Computational Chemistry
North Chicago, IL · On-site +1
$88K - $120K/yr
Knowledge in one or more areas of the computational chemistry discipline, such as quantum mechanics ... chemistry, molecular reactivity, molecular dynamics, structure-based design, ligand-based design ...
Quick apply
Senior Scientist I Computational Chemistry
North Chicago, IL · On-site +1
$88K - $120K/yr
Knowledge in one or more areas of the computational chemistry discipline, such as quantum mechanics ... chemistry, molecular reactivity, molecular dynamics, structure-based design, ligand-based design ...
Senior Scientist I Computational Chemistry
North Chicago, IL · On-site +1
$88K - $120K/yr
Knowledge in one or more areas of the computational chemistry discipline, such as quantum mechanics ... chemistry, molecular reactivity, molecular dynamics, structure-based design, ligand-based design ...
Senior Scientist I Computational Chemistry
North Chicago, IL · On-site +1
$88K - $120K/yr
Knowledge in one or more areas of the computational chemistry discipline, such as quantum mechanics ... chemistry, molecular reactivity, molecular dynamics, structure-based design, ligand-based design ...
... catalysis, quantum chemistry, and artificial intelligence. This position offers an exciting ... Conduct computational studies of catalytic active sites and reaction pathways using quantum ...
... catalysis, quantum chemistry, and artificial intelligence. This position offers an exciting ... Conduct computational studies of catalytic active sites and reaction pathways using quantum ...
Postdoctoral Appointee - AI-Driven Computational Catalysis
Lumberton, NC · On-site
$72K - $121K/yr
... catalysis, quantum chemistry, and artificial intelligence. This position offers an exciting ... Conduct computational studies of catalytic active sites and reaction pathways using quantum ...
Postdoctoral Appointee - AI-Driven Computational Catalysis
Lumberton, NC · On-site
$72K - $121K/yr
... catalysis, quantum chemistry, and artificial intelligence. This position offers an exciting ... Conduct computational studies of catalytic active sites and reaction pathways using quantum ...
Postdoctoral Associate
Blacksburg, VA · On-site
D. in Theoretical Physics, Theoretical Quantum Chemistry, or a closely related field. PhD must be ... in computational methods Overtime Status Exempt: Not eligible for overtime Appointment Type ...
Postdoctoral Associate
Blacksburg, VA · On-site
D. in Theoretical Physics, Theoretical Quantum Chemistry, or a closely related field. PhD must be ... in computational methods Overtime Status Exempt: Not eligible for overtime Appointment Type ...
Post Doctoral Associate in the Center for Molecular Magnetic Quantum Materials (M2QM)
Gainesville, FL · On-site
$48K - $58K/yr
... computational understanding of their many-body quantum behavior. The fundamental science of the ... Experience in DFT and beyond DFT methods, high-level quantum chemistry, machine learning, high ...
Post Doctoral Associate in the Center for Molecular Magnetic Quantum Materials (M2QM)
Gainesville, FL · On-site
$48K - $58K/yr
... computational understanding of their many-body quantum behavior. The fundamental science of the ... Experience in DFT and beyond DFT methods, high-level quantum chemistry, machine learning, high ...
Computational Chemistry About Astellas Astellas is a global life sciences company committed to ... Skilled in homology modeling, pharmacophore modeling, and quantum mechanics/molecular mechanics (QM ...
Computational Chemistry About Astellas Astellas is a global life sciences company committed to ... Skilled in homology modeling, pharmacophore modeling, and quantum mechanics/molecular mechanics (QM ...
Post-doctoral Computational Chemist, Advanced Molecular Design
Indianapolis, IN · On-site
$21 - $28.25/hr
Post-doctoral Computational Chemist Location: Indianapolis, Indiana, United States of America At ... chemistry and organic chemistry * Experience with molecular dynamics simulations, quantum ...
Post-doctoral Computational Chemist, Advanced Molecular Design
Indianapolis, IN · On-site
$21 - $28.25/hr
Post-doctoral Computational Chemist Location: Indianapolis, Indiana, United States of America At ... chemistry and organic chemistry * Experience with molecular dynamics simulations, quantum ...
Post-doctoral Computational Chemist, Advanced Molecular Design
Indianapolis, IN · On-site
$21 - $28.25/hr
Post-doctoral Computational Chemist Location: Indianapolis, Indiana, United States of America At ... chemistry and organic chemistry * Experience with molecular dynamics simulations, quantum ...
Post-doctoral Computational Chemist, Advanced Molecular Design
Indianapolis, IN · On-site
$21 - $28.25/hr
Post-doctoral Computational Chemist Location: Indianapolis, Indiana, United States of America At ... chemistry and organic chemistry * Experience with molecular dynamics simulations, quantum ...
D. in Theoretical Physics, Theoretical Quantum Chemistry, or a closely related field. PhD must be ... in computational methods Overtime Status Exempt: Not eligible for overtime Appointment Type ...
D. in Theoretical Physics, Theoretical Quantum Chemistry, or a closely related field. PhD must be ... in computational methods Overtime Status Exempt: Not eligible for overtime Appointment Type ...
Staff Scientist - College of Pharmacy
Minneapolis, MN · On-site
$70K - $80K/mo
... wide computational chemistry / biology support. The main duties will be to conduct molecular ... The success of this position will require expertise in quantum chemistry, molecular mechanics ...
Staff Scientist - College of Pharmacy
Minneapolis, MN · On-site
$70K - $80K/mo
... wide computational chemistry / biology support. The main duties will be to conduct molecular ... The success of this position will require expertise in quantum chemistry, molecular mechanics ...
Computational Quantum Chemistry information
See salary details
$12.50 - $14.20
1% of jobs
$14.20 - $15.91
11% of jobs
$15.91 - $17.61
13% of jobs
$17.63 is the 25th percentile. Wages below this are outliers.
$17.61 - $19.32
24% of jobs
The median wage is $19.48 / hr.
$19.32 - $21.02
17% of jobs
$22.27 is the 75th percentile. Wages above this are outliers.
$21.02 - $22.73
13% of jobs
$22.73 - $24.43
9% of jobs
$24.43 - $26.14
6% of jobs
$26.14 - $27.84
3% of jobs
$27.84 - $29.55
2% of jobs
$29.55 - $31.25
1% of jobs
$12
$20
$31
How much do computational quantum chemistry jobs pay per hour?
As of Aug 11, 2026, the average hourly pay for computational quantum chemistry in the United States is $20.85, according to ZipRecruiter salary data. Most workers in this role earn between $17.55 and $23.32 per hour, depending on experience, location, and employer.
What are the key skills and qualifications needed to thrive as a computational quantum chemist?
To excel as a Computational Quantum Chemist, you need a strong background in quantum mechanics, theoretical chemistry, advanced mathematics, and typically a Ph.D. in chemistry or a related field. Proficiency with quantum chemistry software (such as Gaussian, ORCA, or Q-Chem), programming languages (like Python or Fortran), and high-performance computing environments is important. Strong problem-solving skills, critical thinking, and the ability to communicate complex concepts clearly are highly valued soft skills. These competencies enable accurate modeling of molecular systems, effective collaboration with multidisciplinary teams, and impactful contributions to scientific research.
What is the difference between Computational Quantum Chemistry vs Computational Chemist?
| Aspect | Computational Quantum Chemistry | Computational Chemist |
|---|---|---|
| Required Credentials | Advanced degrees in chemistry, physics, or related fields; knowledge of quantum mechanics | Similar educational background; often includes programming and chemistry expertise |
| Work Environment | Research labs, academia, industry; focus on theoretical modeling | Research and development settings; practical application of simulations |
| Industry Usage | Primarily in chemical research, pharmaceuticals, materials science | Broader industry roles including product development, materials, and pharmaceuticals |
Computational Quantum Chemistry specializes in applying quantum mechanics to model molecular systems, while Computational Chemist covers a broader range of computational techniques in chemistry. Both roles require similar educational backgrounds and often work in research environments, but their focus areas differ—one on fundamental quantum calculations, the other on practical applications.
What are some typical challenges faced by professionals in computational quantum chemistry, and how can they be addressed?
Professionals in computational quantum chemistry often encounter challenges such as balancing computational resource limitations with the need for high-accuracy simulations, managing large and complex datasets, and staying up to date with rapidly evolving software and algorithms. These challenges can be addressed by collaborating closely with interdisciplinary teams, leveraging high-performance computing resources, and participating in ongoing training or workshops. Additionally, regular communication with experimental chemists helps ensure that computational results are relevant and actionable.
What is computational quantum chemistry?
Computational quantum chemistry is a branch of chemistry that uses computer simulations to solve quantum mechanical equations for molecules and materials. By employing mathematical models and computational algorithms, scientists can predict molecular structures, energies, spectra, and reactivity without needing to perform physical experiments. This field plays a crucial role in understanding chemical processes at the atomic level and accelerating discoveries in drug design, materials science, and nanotechnology.
More about Computational Quantum Chemistry jobs
What states have the most Computational Quantum Chemistry jobs? States with the most job openings for Computational Quantum Chemistry jobs include:
What job categories do people searching Computational Quantum Chemistry jobs look for? The top searched job categories for Computational Quantum Chemistry jobs are:
- Remote Computational Chemistry
- Computational Neuroscience Remote
- Remote Postdoctoral Research Computational Chemistry
- Molecular Docking
- Schrodinger
- Remote Theoretical Computational Chemistry
- Computational Biochemistry
- Biophysics Remote
- Remote Protein Biochemistry Postdoc
- Contractual Organic Chemistry Postdoctoral
Full-time
Re-posted 15 days ago
Amazon rating
7.4
Based on 7,079 frontline employees who took The Breakroom Quiz
6th of 39 rated national retailers
Job description
The Quantum Algorithms Team at the Amazon Web Services (AWS) Center for Quantum Computing (CQC) is looking to hire an Applied Scientist. In this role, you will conduct theoretical research into applications of fault-tolerant quantum computers and develop new quantum algorithms. You will work on the forefront of quantum computing research and contribute toward the development of useful quantum technology, working alongside theoretical and experimental scientists, engineers, and technicians across the CQC.
You should have a deep and broad knowledge of quantum algorithms and applications for fault-tolerant quantum computers, and standard mathematical and computational methods for analyzing them.
Key job responsibilities
We are looking to hire an Applied Scientist focused on developing algorithms and applications for fault-tolerant quantum computers. In this role, you will:
- Collaborate with other members of the Quantum Algorithms Team and our academic collaborators, to analyze and optimize existing quantum algorithms
- Think big to invent new quantum algorithms and discover new application areas for fault-tolerant quantum computers
- Provide subject matter expertise on the topic of quantum algorithms, and communicate the latest developments to the broader quantum computing team
- Work with internal and external stakeholders to strengthen the long-term value proposition of quantum computing
- Interact with the Quantum Error Correction team to understand the interplay between quantum algorithms and quantum error correction
- Publish research papers in scientific journals and present at conferences
- Mentor research interns working on scientific projects
You are expected to develop and lead high-impact research projects that intersect with our engineering roadmap.
Organization and communication skills are essential.
A day in the life
As an Applied Scientist on the Quantum Algorithms team, you develop practical applications for quantum computers. To do so, you will:
- Read academic publications, understand their practical applicability, and present the results in internal meetings
- Analyze and optimize existing quantum algorithms in domains such as quantum simulation, quantum chemistry, optimization, or machine learning - or develop entirely new algorithms
- Perform resource estimates to quantify the cost of running quantum algorithms within a given hardware architecture
- Write technical internal reports documenting research findings and analysis
- Write research papers and present your research results at flagship academic and industry conferences.
About Amazon
Sourced by ZipRecruiter
Amazon.com, Inc., commonly known as Amazon, is an American multinational technology company. It was founded by Jeff Bezos in 1994 and initially started as an online marketplace for books. Since then, Amazon has expanded its operations and become one of the largest e-commerce companies in the world. Amazon's primary business is its online retail platform, where customers can purchase a vast array of products, including electronics, clothing, books, home goods, and much more. The company offers a convenient and user-friendly shopping experience, with features such as fast shipping, customer reviews, and personalized recommendations. In addition to its e-commerce platform, Amazon has diversified its business into various other areas. One of its notable ventures is Amazon Web Services (AWS), a comprehensive cloud computing platform that provides services such as storage, compute power, and database management to individuals and businesses. AWS has become a leader in the cloud computing industry, powering many websites and applications worldwide. Amazon has also developed its own consumer electronics, including the popular Amazon Kindle e-reader, Fire tablets, Fire TV streaming devices, and the Alexa-powered Echo smart speakers. The Alexa voice assistant, integrated into these devices, allows users to interact with their devices using voice commands, perform tasks, and access information. Furthermore, Amazon has expanded into media and entertainment. It operates Prime Video, a streaming service that offers a wide range of movies, TV shows, and original content. Amazon Music provides a platform for streaming and purchasing digital music, while Audible offers audiobooks and other audio content. The company's commitment to customer satisfaction and convenience is demonstrated by its membership program, Amazon Prime. Prime members receive various benefits, including free two-day shipping, access to streaming services, exclusive deals, and more.
Industry
It services, book publishers, retail, real estate and computer and electronic product manufacturing
Company size
10,000+ Employees
Headquarters location
Seattle, WA, US