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Entry Level Density Functional Theory Jobs (NOW HIRING)

Ucf

Post Doctoral Scholar

Orlando, FL · On-site

$57K/yr

Demonstrated expertise in density functional theory calculations and hold (or expect to obtain soon) a PhD in computational materials physics or a related field; Excellent oral and written ...

Ucf

Postdoctoral Scholar, Physics

Orlando, FL

An ideal candidate should have experience in modeling electrochemical reactions on surfaces and interfaces using first-principles density functional theory (DFT), grand canonical DFT (GC-DFT ...

AV

Entry-Level Software Engineer

Dayton, OH · On-site

... functional test plan execution. Qualifications : Required : • Bachelor's degree in Computer ... theoretical requirements. Founded in 1971, the company is headquartered in Arlington, USA, with a ...

BRM.ai

Entry Level Software Engineer

San Francisco, CA · On-site

Work closely with cross-functional teams to understand how engineering decisions impact product and ... You value practical experience over theoretical knowledge * Team player: Strong communication ...

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Entry Level Density Functional Theory information

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How much do entry level density functional theory jobs pay per hour?

As of Jul 5, 2026, the average hourly pay for entry level density functional theory in the United States is $17.46, according to ZipRecruiter salary data. Most workers in this role earn between $15.62 and $18.99 per hour, depending on experience, location, and employer.

What are some typical challenges faced by entry-level Density Functional Theory (DFT) researchers, and how can they be addressed?

Entry-level DFT researchers often encounter challenges such as mastering complex computational software, interpreting simulation results, and keeping up with rapidly evolving methodologies. Learning to troubleshoot code errors and efficiently set up simulations can be time-consuming at first. Collaborating closely with senior researchers, participating in group discussions, and utilizing online forums or tutorials can significantly accelerate the learning curve. Over time, hands-on practice and seeking feedback help build confidence and expertise.

What are entry level Density Functional Theory jobs?

Entry level Density Functional Theory (DFT) jobs typically involve using computational chemistry methods to study the electronic structure of molecules and materials. These roles are often suited for recent graduates or those with limited professional experience in computational chemistry or physics. Entry level DFT positions may include tasks such as running simulations, analyzing data, and assisting in research projects under the guidance of senior scientists. Candidates usually need a background in chemistry, physics, materials science, or a related field, along with some experience in computational modeling or quantum chemistry software. These roles are found in academia, research institutions, and industries like pharmaceuticals or materials science.

What is the difference between Entry Level Density Functional Theory vs Entry Level Computational Chemist?

AspectEntry Level Density Functional TheoryEntry Level Computational Chemist
Required CredentialsBachelor's degree in chemistry, physics, or related field; basic knowledge of quantum mechanicsBachelor's degree in chemistry, chemical engineering, or related; familiarity with computational methods
Work EnvironmentResearch labs, academic institutions, or industry R&D teamsLaboratories, research institutions, or pharmaceutical companies
Industry UsagePrimarily used in theoretical and computational chemistry researchApplied in drug discovery, materials science, and chemical research

Entry Level Density Functional Theory focuses specifically on quantum mechanical calculations to study electronic structures, while Entry Level Computational Chemist has a broader scope, including various computational methods for chemical analysis. Both roles require similar educational backgrounds and are often found in research settings, but their applications differ in focus and complexity.

What are the key skills and qualifications needed to thrive as an Entry Level Density Functional Theory (DFT) Researcher, and why are they important?

To thrive as an entry-level DFT researcher, you need a background in physics, chemistry, or materials science, along with foundational knowledge of quantum mechanics and computational modeling. Familiarity with DFT software packages (such as VASP, Quantum ESPRESSO, or Gaussian) and basic programming skills in Python or Fortran are often required. Strong analytical thinking, attention to detail, and effective communication help in interpreting results and collaborating with research teams. These skills and qualifications are crucial for conducting accurate simulations, troubleshooting computational challenges, and contributing to scientific advancements.
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Entry Level Density Functional Theory jobs near you
Infographic showing various Entry Level Density Functional Theory job openings in the United States as of June 2026, with employment types broken down into 3% As Needed, 94% Full Time, and 3% Contract. Highlights an 88% Physical, 4% Hybrid, and 8% Remote job distribution, with an average salary of $36,327 per year, or $17.5 per hour.
AI Research Engineer, FAIR Chemistry

AI Research Engineer, FAIR Chemistry

Meta

Menlo Park, CA

$121K/yr

Full-time

Posted 13 days ago

Meta rating

7.5

Company rating: 7.5 out of 10

Based on 44 frontline employees who took The Breakroom Quiz

130th of 202 rated software companies

Job description

Meta is seeking a researcher to join the Fundamental AI Research (FAIR) Chemistry team, a research organization focused on advancing the state-of-the-art in AI. In this role, you'll work with world-class researchers at FAIR on fundamental and exploratory research. Our current projects include new datasets, models, and capabilities to accelerate chemistry and materials science. Our organization is motivated by producing new science to understand intelligence and technology towards achieving advanced machine intelligence. In this specific role, you will develop and enhance capabilities for modeling complex battery and electrolyte chemistries.
AI Research Engineer, FAIR Chemistry Responsibilities:
  • Provide technical leadership for a scientific direction in AI for science.
  • Perform research that advances the state-of-the-art in AI for chemistry and materials science.
  • Work closely with internal and external partners to realize impact of methods advances.
  • Work towards long-term goals, while identifying intermediate milestones.
  • Influence progress of relevant research communities by producing publications.
  • Open source high quality code and produce reproducible research.
  • Enhance the capabilities of FAIR chemistry models in complex chemical environments like electrolytes or strong applied fields.

Minimum Qualifications:
  • First-authored or last-authored publications at peer-reviewed conferences, such as ICML, NeurIPS, ICLR, and other similar venues, or domain scientific journals
  • Master's Degree or PhD in AI, computer science, data science, science/engineering, or related technical fields
  • Bachelor's degree in Computer Science, Computer Engineering, relevant technical field, or equivalent practical experience
  • Research background in machine learning, artificial intelligence, computational statistics, applied mathematics, AI for science, or related areas
  • Experience in developing and debugging in Python or similar programming languages
  • Currently has, or is in the process of obtaining a Bachelor's degree in Computer Science, Computer Engineering, relevant technical field, or equivalent practical experience. Degree must be completed prior to joining Meta

Preferred Qualifications:
  • Experience collaborating in a team environment on research projects
  • Experience in molecular simulations for batteries, complex electrolytes, or simulation techniques like grand canonical density functional theory
  • Research and engineering experience demonstrated via publications, grants, fellowships, patents, open source code
  • Experience in applying AI systems to solve science and engineering problems

About Meta:
Meta builds technologies that help people connect, find communities, and grow businesses. When Facebook launched in 2004, it changed the way people connect. Apps like Messenger, Instagram and WhatsApp further empowered billions around the world. Now, Meta is moving beyond 2D screens toward immersive experiences like augmented and virtual reality to help build the next evolution in social technology. People who choose to build their careers by building with us at Meta help shape a future that will take us beyond what digital connection makes possible today—beyond the constraints of screens, the limits of distance, and even the rules of physics.
Meta is proud to be an Equal Employment Opportunity and Affirmative Action employer. We do not discriminate based upon race, religion, color, national origin, sex (including pregnancy, childbirth, or related medical conditions), sexual orientation, gender, gender identity, gender expression, transgender status, sexual stereotypes, age, status as a protected veteran, status as an individual with a disability, or other applicable legally protected characteristics. We also consider qualified applicants with criminal histories, consistent with applicable federal, state and local law. Meta participates in the E-Verify program in certain locations, as required by law. Please note that Meta may leverage artificial intelligence and machine learning technologies in connection with applications for employment.
Meta is committed to providing reasonable accommodations for candidates with disabilities in our recruiting process. If you need any assistance or accommodations due to a disability, please let us know at accommodations-ext@meta.com.
$121,992/year to $181,000/year + bonus + equity + benefits
Individual compensation is determined by skills, qualifications, experience, and location. Compensation details listed in this posting reflect the base hourly rate, monthly rate, or annual salary only, and do not include bonus, equity or sales incentives, if applicable. In addition to base compensation, Meta offers benefits. Learn more about benefits at Meta.

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