Research Project
Research Project
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Under the guidance of Prof. Ajay Singh Panwar, Dept. of Metallurgical Engineering and Materials Science, IIT Bombay
Using ReaxFF potential to run Molecular Dynamics Simulation and capture hydrogen bond formation and its effects on water diffusivity in Graphene Oxide
Using ReaxFF potential to run Molecular Dynamics Simulation and capture hydrogen bond formation and its effects on water diffusivity in Graphene Oxide
Mean Square Displacement of water around Graphene sheets with different number of Hydroxyl groups
Temperature induced phase transformation of NiTi alloy
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