if anyone want to work together or anything in return of helping then contact me [email protected]
Dear Ankit Kumar
I hope this message finds you well. Your research into quantum supercapacitors is truly fascinating, and I appreciate the opportunity to discuss your approach to quantum capacitance calculations using SIESTA.
To begin, it may be helpful to clarify how you define quantum capacitance within the context of your system. Since quantum capacitance is closely tied to the electronic properties under investigation, establishing a clear definition will guide the computational strategy. Have you considered which specific electronic characteristics or density of states features are most relevant for your analysis?
Regarding your work with SIESTA, I am curious about the steps you have already taken or plan to take. Are there particular parameters, models, or simulation setups you are focusing on? If you have encountered any challenges—such as selecting appropriate exchange-correlation functionals, setting up the k-point mesh, or interpreting the output—please let me know. Discussing these aspects could help us identify effective strategies or alternative approaches.
I look forward to hearing more about your methodology and any specific questions you might have. Please feel free to share further details or let me know how I can assist you in advancing your calculations.
My recently published article:
Article Hierarchical Ni-Mn Double Layered/Graphene Oxide with Excell...
Best regards,
Kosh
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