Position Summary
Position:
Department:
Department of Chemical Engineering
Institute:
IIT Kanpur
Country:
India
Research Field:
Computational Physics , Computational Chemistry , Python
Posted Date:
Apr 07, 2026
Deadline:
Apr 25, 2026
Offer Period:
1 year
Offer Start Date:
NA
Project Post-Doctoral Fellow position in
Project Description:
- IIT KANPUR invites application for the post of Project Post-Doctoral Fellow in the Project.
- We are seeking a highly motivated Postdoctoral Researcher to join our AI4Science initiative, focusing on the intersection of molecular simulation, quantum mechanics, and machine learning.
- The successful candidate will have demonstrated expertise in force-field development, with strong proficiency in quantum mechanical (QM) methods and molecular dynamics (MD) simulations. A key component of this role is the automated development of reactive force fields using Bayesian optimization and related data-driven techniques, and extending towards universal MLP.
- In addition, the candidate will contribute to the discovery of next-generation materials through inverse design frameworks, integrating physics-based modeling with modern AI approaches. This work aims to accelerate materials innovation by bridging molecular-scale understanding with data-driven optimization.
- Applicants should possess a strong foundation in applied mathematics and computational methods, along with a proven record of impactful research, evidenced by publications or prior project outcomes.
Required Qualification:
Essential Qualification:
- Ph.D. in Chemical Engineering, Computational Physics, Computational Chemistry, Computation Material Science and Engineering
Preferred Qualification:
- Strong background in statistical mechanics, molecular simulations and thermodynamics.
- Significant experience in quantum mechanical calculations
- Strong programming skills (e.g., Python, C/C++, or related)
- Familiarity with Bayesian optimization, machine learning, or AI-driven modeling
- Experience with reactive force fields (e.g., ReaxFF or similar frameworks).
Employment Conditions and Benefits:
Contract duration:
- The appointment for the above posts initially will be for 1 year, which will be extended with mutual consent If performance of the candidate is good,
- The post is purely temporary and on a contractual basis.
Benefits:
- Salary Range : 60,000/5000/85000
Application Process:
Documents Required:
Not Available
How to apply:
- Email : jksrecruitment@gmail.com
About the Host Lab Group/Institution:
Established in 1959, the Indian Institute of Technology Kanpur (IITK) is a premier, first-generation institution in Uttar Pradesh known for engineering, science, and research excellence. Located on a sprawling campus, it hosts over 9,500 students and 570 faculty members, fostering high-impact innovation with over 1,000 patents filed and 150+ incubated companies. IIT Kanpur is renowned for its strong academic rigor, particularly as a pioneer in computer science, having introduced India's first computer science education in the 1960s. The institute offers diverse undergraduate and postgraduate programs across 20+ departments, including engineering, humanities, and design. Ranked highly globally (#222 in 2026 QS World University Rankings
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Frequently Asked Questions:
Who can apply for a postdoctoral position?
Postdoctoral positions are open to candidates who have completed a PhD or will complete their doctoral degree before the start date. Eligibility requirements may vary depending on the funding scheme and host institution.
Can international candidates apply?
Yes. Most postdoctoral positions are open to international applicants. Visa sponsorship and work permit support are usually provided by the host institution, subject to local regulations.
Is prior postdoctoral experience required?
In most cases, prior postdoctoral experience is not mandatory. However, candidates with relevant research experience beyond the PhD may be preferred for certain positions.
What is the typical duration of a postdoctoral contract?
Postdoctoral contracts typically range from six months to three years, with the possibility of extension depending on funding availability and performance.
Are teaching responsibilities included?
Teaching responsibilities vary by institution and position. Some postdoctoral roles are research-only, while others may include limited teaching or supervision duties.
Can I apply for multiple postdoctoral positions?
Yes. Candidates are encouraged to apply for multiple suitable postdoctoral positions to increase their chances of selection.
Disclaimer:
This position is published for informational purposes. Please refer to the official application link for the most accurate and up-to-date details.