Welcome to my computational materials research blog, and thank you for stopping by. Through this site, I take the opportunity to share my research vision, interest, and accomplishments with you. I ...
Computational Materials Research
Materials Design Materials Design is at the forefront of my research. The successful materials design (or prediction) leads to accelerated materials discovery, saving time and money. I employ \({\i...
Open-Source Codes
Python Chemical potential landscape analysis for predicting phase stabiity and thermodynamic growth conditions Proximal radial distribution function for estimating molecular and s...
Published and Working Papers
Refereed research papers Dursun, I., Terban, M., Xu, Y., Zhang, X., Ghose, S., Li, M., P. Sarker, Li, H., Cotlet, M., Wei, T., Lu, D., & Yu, Q. (2023). Temperature-dependent optical and structu...
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