Computational Materials Scientist
Bengaluru, KA, IN

About us
At ExxonMobil, our vision is to lead in energy innovations that advance modern living and a net-zero future. As one of the world’s largest publicly traded energy and chemical companies, we are powered by a unique and diverse workforce fueled by the pride in what we do and what we stand for.
The success of our Upstream, Product Solutions and Low Carbon Solutions businesses is the result of the talent, curiosity and drive of our people. They bring solutions every day to optimize our strategy in energy, chemicals, lubricants and lower-emissions technologies.
We invite you to bring your ideas to ExxonMobil to help create sustainable solutions that improve quality of life and meet society’s evolving needs. Learn more about our What and our Why and how we can work together.
ExxonMobil’s affiliates in India
ExxonMobil’s affiliates have offices in India in Bengaluru, Mumbai and the National Capital Region.
ExxonMobil’s affiliates in India supporting the Product Solutions business engage in the marketing, sales and distribution of performance as well as specialty products across chemicals and lubricants businesses. The India planning teams are also embedded with global business units for business planning and analytics.
ExxonMobil’s LNG affiliate in India supporting the upstream business provides consultant services for other ExxonMobil upstream affiliates and conducts LNG market-development activities.
The Global Business Center - Technology Center provides a range of technical and business support services for ExxonMobil’s operations around the globe.
ExxonMobil strives to make a positive contribution to the communities where we operate and its affiliates support a range of education, health and community-building programs in India. Read more about our Corporate Responsibility Framework.
To know more about ExxonMobil in India, visit ExxonMobil India and the Energy Factor India.
What role you will play in our team
We are seeking candidates with a strong research record and expertise in Computational Materials Science and Engineering or related fields. The role focuses on designing material structures, predicting properties and behaviors, and applying advanced modeling techniques to accelerate materials discovery and development, particularly in polymers, complex fluids, structural and functional materials.
You will work across a wide range of applications where key material properties, such as mechanical performance, rheology, thermodynamics, and stability, are critical to success. This position requires strong expertise in a variety of computational techniques and broad experience in modeling and simulating complex materials (e.g., polymers) under real-world conditions and uncovering structure–process–property–performance relationships.
What you will do
- Apply advanced modeling to accelerate materials discovery and development and enable in-silico materials design
- Investigate physical processes and mechanisms across multiple length and time scales.
- Collaborate closely with experimentalists and other modeling experts to validate and improve models.
- Develop and deploy computational models that address business needs and enhance research workflows.
Skills and Qualifications:
- Ph.D. in Materials Science and Engineering, Chemical Engineering, Chemistry, Physics, Computational Science, or related fields.
- Minimum 3 years of research experience in materials modeling (including Ph.D. research).
- Proven experience in modeling and simulating behavior of complex materials such as semicrystalline polymers, hydrocarbons, soft matter, complex fluids, and composites.
- Proficiency in atomistic simulations, Density Functional Theory, molecular dynamics, Monte Carlo, coarse-grained methods, and/or finite element analysis.
- Expertise in multiscale and multi-physics modeling, including techniques from ab-initio to continuum methods across a broad range of time and length scales.
- Experience with hybrid modeling and integrating physics-based and data-driven methods (e.g., machine learning)
- Experience with forcefield development and MLIPs (Machine Learning Interatomic Potentials).
- Experience with both CPU and GPU high-performance computing.
- Strong programming skills (Python, C++, scripting for automation).
- Excellent communication and collaboration skills across multidisciplinary teams.
Preferred Experiences:
- Polymer physics, soft matter physics, fluid mechanics
- Thermodynamics, statistical mechanics, interface science, and kinetic modeling
- Machine learning, statistical modeling, materials informatics
- Experience in energy and sustainability-related materials
Your Benefits
An ExxonMobil career is one designed to last. Our commitment to you runs deep: our employees grow personally and professionally, with benefits built on our core categories of health, security, finance and life. We offer you:
- Competitive compensation
- Medical plans, maternity leave and benefits, life, accidental death and dismemberment benefits
- Retirement benefits
- Global networking & cross-functional opportunities
- Annual vacations & holidays
- Day care assistance program
- Training and development program
- Tuition assistance program
- Workplace flexibility policy
- Relocation program
- Transportation facility
Please note benefits may change from time to time without notice, subject to applicable laws. The benefits programs are based on the Company’s eligibility guidelines.
Stay Connected With Us
- Learn more about ExxonMobil in India, visit ExxonMobil India and Energy Factor India.
- Follow us on LinkedIn and Instagram
- Like us on Facebook
- Subscribe our channel at YouTube
EEO Statement
ExxonMobil is an Equal Opportunity Employer. All qualified applicants will receive consideration for employment without regard to race, color, religion, sex, age, national origin or disability status.
Business solicitation and recruiting scams
ExxonMobil does not use recruiting or placement agencies that charge candidates an advance fee of any kind (e.g., placement fees, immigration processing fees, etc.). Follow the LINK to understand more about recruitment scams in the name of ExxonMobil.
Nothing herein is intended to override the corporate separateness of local entities. Working relationships discussed herein do not necessarily represent a reporting connection, but may reflect a functional guidance, stewardship, or service relationship.
Exxon Mobil Corporation has numerous affiliates, many with names that include ExxonMobil, Exxon, Esso and Mobil. For convenience and simplicity, those terms and terms like corporation, company, our, we and its are sometimes used as abbreviated references to specific affiliates or affiliate groups. Abbreviated references describing global or regional operational organizations and global or regional business lines are also sometimes used for convenience and simplicity. Similarly, ExxonMobil has business relationships with thousands of customers, suppliers, governments, and others. For convenience and simplicity, words like venture, joint venture, partnership, co-venturer, and partner are used to indicate business relationships involving common activities and interests, and those words may not indicate precise legal relationships.
Job Segment:
Sustainability, CSR, Chemical Engineer, Informatics, Energy, Research, Management, Engineering, Technology