Mr. Sathya Arumugam Thirumalai | Indian Institute of Technology Roorkee | India
Mr. Sathya Arumugam Thirumalai is a highly motivated researcher whose work integrates Computational Methods with experimental nanomaterial science, emphasizing sustainability, environmental protection, and advanced detection technologies. His academic journey, from IIT Roorkee to TU Dresden, reflects an enduring commitment to merging experimental nanotechnology with Computational Methods for the synthesis and characterization of perovskite, MXene, and 2D materials. Mr. Sathya’s professional experience spans renowned institutions like IISc Bengaluru, BARC Mumbai, and IIT Roorkee, where he utilized Computational Methods in density functional theory (DFT) simulations, material modeling, and radiation detector design. His research, grounded in Computational Methods, has contributed to multiple journal publications addressing gas sensing, field emission, and radiation detection. He applies Computational Methods to optimize nanomaterial performance, enhance photonic properties, and improve the efficiency of radiation detectors. Recognized with several awards and fellowships, including the National Talent Search Fellowship and the Saxon Student Mobility Grant, he has demonstrated excellence in both theoretical and practical domains. His technical mastery extends to Python, MATLAB, COMSOL, and VASP, emphasizing his strength in applying Computational Methods across interdisciplinary fields. Mr. Sathya’s skill in Computational Methods enables him to bridge theoretical simulations with experimental validation, ensuring scientific precision and innovation. His collaborative engagements with global research groups highlight his leadership and cross-disciplinary adaptability. In conclusion, Mr. Sathya exemplifies how Computational Methods can revolutionize material science, fostering technological advancements that align with sustainability and human welfare.
Profiles: Google Scholar | ORCID
Featured Publications
1. Sathya, A. T., Jethawa, U., Sarkar, S. G., & Chakraborty, B. (2025). Pd-decorated MoSi₂N₄ monolayer: Enhanced nitrobenzene sensing through DFT perspective. Journal of Molecular Liquids, 427, 127310.
2. Sathya, A. T., Kandasamy, M., & Chakraborty, B. (2024). Strain induced nitrobenzene sensing performance of MoSi₂N₄ monolayer: Investigation from density functional theory. Surfaces and Interfaces, 55, 105386.
3. Sanyal, G., Vaidyanathan, A., Sathya, A. T., & Chakraborty, B. (2025). Efficient catechol sensing in newly synthesized 2D material Ti₂B MBene: Insights from density functional theory simulations. Langmuir, 41(33), 22525–22534.
4. Sathya, A. T., Sarkar, S. G., Bakhtsingh, R. I., & Mondal, J. (2024). Suppression of shielding effect of large area field emitter cathode in radio frequency gun environment. Physica Scripta, 99(12), 125301.