39 citations · 195 across the 21 of their papers we have counts for
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Understanding the Strength of the Selenium -- Graphene Interfaces
Vidushi Sharma, David Mitlin, Dibakar Datta
We present a comprehensive first-principles Density Functional Theory (DFT) analyses of the interfacial strength and bonding mechanisms between crystalline and amorphous selenium(S…
Variation in interface strength of Silicon with surface engineered Ti3C2 MXenes
Vidushi Sharma, Dibakar Datta
Current advancements in battery technologies require electrodes to combine high-performance active material such as Silicon (Si) with two-dimensional materials such as transition m…
Machine Learning in Materials Modeling -- Fundamentals and the Opportunities in 2D Materials
Shreeja Das, Hansraj Pegu, Kisor Sahu +4
The application of machine learning in materials presents a unique challenge of dealing with scarce and varied materials data - both experimental and theoretical. Nevertheless, sev…
Comprehensive understanding of water-driven graphene wrinkle life-cycle towards applications in flexible electronics: A computational study
Jatin Kashyap, Eui-Hyeok Yang, Dibakar Datta
The presence of wrinkles in Graphene Nanoribbons (GNR) and other two-dimensional (2D) materials significantly alter their mechanical, electronic, optical properties, which can be e…